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Profile: SynphaBase AG specializes in the field of organic and medical chemistry. We are ISO 9001:2000 certified. We provide process R&D services which focus on the improvement or adaptation of existing synthesis protocols and development of efficient production processes. We also provide lab scale synthesis service which includes synthesis of building blocks and scaffolds, synthesis of metabolites, impurities and chemical & enzymatical separation of racemic mixtures.

1 to 50 of 96 Products/Chemicals (Click for related suppliers)  Page: [1] 2 >> Next 50 Results
• Acetic Acid 4-Oxo-Cyclohexyl Ester
IUPAC Name: (4-oxocyclohexyl) acetate | CAS Registry Number: 41043-88-3
Synonyms: 4-Oxocyclohexyl acetate, Acetic acid 4-oxo-cyclohexyl ester, (4-oxocyclohexyl) acetate, AC1LBX82, AC1Q60YT, SureCN1207769, Cyclohexanone,4-(acetyloxy)-, CTK4I4192, MolPort-003-824-978, Acetic acid, 4-oxocyclohexyl ester, AR-1G4284, SPB-80090, ZINC21994755, AKOS006286384, AC-5138, AG-K-83427, AK112287, KB-47062, FT-0692569, Cyclohexanone,4-hydroxy-, acetate (6CI);4-Acetoxycyclohexanone;4-(Acetyloxy)cyclohexanone;

Molecular Formula: C8H12O3Molecular Weight: 156.179080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: YBMRTOLIRJUOPL-UHFFFAOYSA-N

• Acetobromo-alpha-D-glucose
IUPAC Name: [(2R,3R,4S,5R,6R)-4,5-diacetyloxy-2-(acetyloxymethyl)-6-bromooxan-3-yl] acetate | CAS Registry Number: 572-09-8
Synonyms: Acetobromglucose, A1750_SIGMA, 00530_FLUKA, EINECS 209-339-0, ZINC04262104, alpha-D-Glucopyranosyl bromide, tetraacetate, TL8003684, 2,3,4,6-Tetra-O-acetyl-alpha-D-glucopyranosyl bromide, 2,3,4,6-O-Tetraacetyl-alpha-D-glucopyranosyl bromide

Molecular Formula: C14H19BrO9Molecular Weight: 411.199260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 9

InChIKey: CYAYKKUWALRRPA-RGDJUOJXSA-N

• Alpha-Phenyl Glycine
IUPAC Name: 2-amino-2-phenylacetic acid | CAS Registry Number: 2835-06-5
Synonyms: 2-Phenylglycine, Phenylglycine, L-Phenylglycine, DL-Phenylglycine, alpha-Phenylgycine, L-2-Phenylglycine, DL-2-Phenylglycine, Glycine, 2-phenyl-, .alpha.-Phenylglycine, DL-alpha-Phenylglycine, ALPHA-PHENYLGLYCINE, 2-Amino-2-phenylacetic acid, L-.alpha.-Phenylglycine, Glycine, 2-phenyl-, L-, DL-.alpha.-Phenylglycine, L-(+)-2-Phenylglycine, (R)-(-)-2-Phenylglycine, alpha-Aminophenylacetic acid, D-(-)-.alpha.-Phenylglycine, .alpha.-Aminobenzeneacetic acid

Molecular Formula: C8H9NO2Molecular Weight: 151.162560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ZGUNAGUHMKGQNY-UHFFFAOYSA-N

• Benzophenone imine
IUPAC Name: di(phenyl)methanimine | CAS Registry Number: 1013-88-3
Synonyms: Diphenylmethanimine, Oprea1_372891, Oprea1_617070, ARONIS000349, Benzenemethanimine, .alpha.-phenyl-, Benzenemethanimine, alpha-phenyl-, 293733_SIAL, ZINC01095290, ST5307507, TL8000092

Molecular Formula: C13H11NMolecular Weight: 181.233140 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: SXZIXHOMFPUIRK-UHFFFAOYSA-N

• Boc-D-Phe-OSu
IUPAC Name: (2,5-dioxopyrrolidin-1-yl) (2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoate | CAS Registry Number: 3674-18-8
Synonyms: Boc-D-phenylalanine N-hydroxysuccinimide ester, ST51037158, 15178_ALDRICH, 15178_FLUKA, MolPort-003-824-870, AKOS016003031, AM82168, AK-81117, KB-48288, 2,5-dioxoazolidinyl (2R)-2-[(tert-butoxy)carbonylamino]-3-phenylpropanoate

Molecular Formula: C18H22N2O6Molecular Weight: 362.377080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: NHUCANAMPJGMQL-CYBMUJFWSA-N

• Boc-Lys(Z)-OSu
IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-6-(phenylmethoxycarbonylamino)hexanoate | CAS Registry Number: 34404-36-9
Synonyms: EINECS 251-999-7, CID118166, Benzyl (S)-(5-(((1,1-dimethylethoxy)carbonyl)amino)-6-((2,5-dioxo-1-pyrrolidinyl)oxy)-6-oxohexyl)carbamate

Molecular Formula: C23H31N3O8Molecular Weight: 477.507540 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: YWLICOCXPNQJPC-UHFFFAOYSA-N

• BOC-PRO-OME
IUPAC Name: 1-O-tert-butyl 2-O-methyl (2S)-pyrrolidine-1,2-dicarboxylate | CAS Registry Number: 59936-29-7
Synonyms: Boc-L-Pro-Ome, Boc-L-proline methyl ester, ARK015, NSC697381, ZINC01095287, CID1277666, TL8003809

Molecular Formula: C11H19NO4Molecular Weight: 229.272860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: WVDGSSCWFMSRHN-QMMMGPOBSA-N

• Boc-Tyr(Bzl)-OSu
IUPAC Name: (2,5-dioxopyrrolidin-1-yl) (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-phenylmethoxyphenyl)propanoate | CAS Registry Number: 34805-19-1
Synonyms: ST51012415, Boc-O-benzyl-L-tyrosine hydroxysuccinimide ester, 15377_ALDRICH, 15377_FLUKA, CTK4F9950, AKOS015841402, AKOS015895912, AG-E-88074, AG-F-19429, FT-0654613, I06-1371, 2,5-dioxoazolidinyl (2S)-2-[(tert-butoxy)carbonylamino]-3-[4-(phenylmethoxy)ph enyl]propanoate, Carbamicacid, [(1S)-2-[(2,5-dioxo-1-pyrrolidinyl)oxy]-2-oxo-1-[[4-(phenylmethoxy)phenyl]methyl]ethyl]-,1,1-dimethylethyl ester (9CI); Carbamic acid,[2-[(2,5-dioxo-1-pyrrolidinyl)oxy]-2-oxo-1-[[4-(phenylmethoxy)phenyl]methyl]ethyl]-,1,1-dimethylethyl ester, (S)-; Succinimide,N-[[3-[p-(benzyloxy)phenyl]-N-carboxy-L-alanyl]oxy]-, tert-butyl ester (8CI);Alanine, 3-[p-(benzyloxy)phenyl]-N-carboxy-, N-tert-butyl ester, succinimidoderiv. (8CI); NSC 334285, L-Tyrosine,N-[(1,1-dimethylethoxy)carbonyl]-O-(phenylmethyl)-, 2,5-dioxo-1-pyrrolidinylester

Molecular Formula: C25H28N2O7Molecular Weight: 468.499020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 7

InChIKey: GKLFTQJJYUFASW-FQEVSTJZSA-N

• Boc-Tyramine
IUPAC Name: tert-butyl N-[2-(4-hydroxyphenyl)ethyl]carbamate | CAS Registry Number: 64318-28-1
Synonyms: ZINC02563753, CID11831452, Tert-butyl N-[2-(4-hydroxyphenyl)ethyl]carbamate

Molecular Formula: C13H19NO3Molecular Weight: 237.294860 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ILNOTKMMDBWGOK-UHFFFAOYSA-N

• Butanoic acid
IUPAC Name: (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid | CAS Registry Number: 159991-23-8
Synonyms: (R)-N-Boc-3-aminobutyric acid, boc-d-3-aminobutyric acid, (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid, (S)-N-Boc-3-aminobutyric acid, AmbotzBAA6090, boc-d-beta-homoalanine, Boc-beta-D-homoalanine, (r)-boc-b2-hoala-oh, boc-d-ala-(c*ch2)oh, (r)-boc-b2-homoalanine, AC1MC53V, TMBA003, CTK4D0287, MolPort-000-001-437, (r)-3-(boc-amino)-butyric acid, 3-n-boc-3-(r)-amino butyric acid, ANW-21855, VT1010, boc protected (r)-b-aminobutyric acid, AG-E-09424

Molecular Formula: C9H17NO4Molecular Weight: 203.235580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: PYNDHEONPQYIAN-ZCFIWIBFSA-N

• Cyclohexanone cyanohydrin
IUPAC Name: 1-hydroxycyclohexane-1-carbonitrile | CAS Registry Number: 931-97-5
Synonyms: Cyclohexanone, cyanohydrin, 1-Hydroxycyclohexanecarbonitrile, 1-Cyano-1-hydroxycyclohexane, Cyclohexanecarbonitrile, 1-hydroxy-, CCRIS 4608, 1-Hydroxycycloheptanecarbonitrile, 1-Hydroxy-1-cyclohexanecarbonitrile, CYCLOHEXANONE CYANOHDRIN, 326186_ALDRICH, EINECS 213-246-0, NSC 14493, NSC 52190, CID13610, NSC14493, NSC52190, BRN 1634973, AI3-37039, LS-1952, NCGC00091113-01, 4-10-00-00021 (Beilstein Handbook Reference)

Molecular Formula: C7H11NOMolecular Weight: 125.168340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ZDBRPNZOTCHLSP-UHFFFAOYSA-N

• Cyclohexanone, 4-hydroxy-
IUPAC Name: 4-hydroxycyclohexan-1-one | CAS Registry Number: 13482-22-9
Synonyms: 4-Hydroxycyclohexanone, 4-Hydroxy-cyclohexanone, 4-hydroxycyclohexan-1-one, SBB056283, AG-D-71212, p-Hydroxycyclohexanone, AC1LBWOD, 4-Oxocyclohexan-1-ol, SureCN148906, 4-hydroxy-cyclohexan-1-one, KSC497C5B, Jsp002121, CTK3J7150, MolPort-000-004-276, ACN-S003465, ANW-73866, RW3918, ZINC13542642, AKOS006344707, QC-3294

Molecular Formula: C6H10O2Molecular Weight: 114.142400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BXBJZYXQHHPVGO-UHFFFAOYSA-N

• D-Mannitol Diacetonide
IUPAC Name: (1S,2S)-1,2-bis[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]ethane-1,2-diol | CAS Registry Number: 1707-77-3
Synonyms: D-Mannitol diacetonide, Diisopropylidene mannitol, 296406_ALDRICH, 38410_FLUKA, CID96011, EINECS 216-954-8, ZINC04521410, 1,2:5,6-Di-O-isopropylidene-D-mannitol, ST5408125, 1,2-5,6-DI-0-ISOPROPYLIDENE-D-MANNITOL

Molecular Formula: C12H22O6Molecular Weight: 262.299480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: ODYBCPSCYHAGHA-ZYUZMQFOSA-N

• Decanedioic Acid Monoethyl Ester
IUPAC Name: 10-ethoxy-10-oxodecanoic acid | CAS Registry Number: 693-55-0
Synonyms: Ethyl sebacate, Monoethyl sebacate, Ethyl hydrogen sebacate, Sebacic acid, monoethyl ester, Decanedioic acid, monoethyl ester, 10-ethoxy-10-oxodecanoic acid, NSC53961, EINECS 211-753-1, NSC 53961, ST5410093

Molecular Formula: C12H22O4Molecular Weight: 230.300680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: DLZCDMPHHUODDO-UHFFFAOYSA-N

• Delta-3-Carene
IUPAC Name: 3,7,7-trimethylbicyclo[4.1.0]hept-3-ene | CAS Registry Number: 13466-78-9
Synonyms: 3-Carene, Carene, Monoterpenes, S-3-Carene, 3-Karen [Czech], Delta-car-3-ene, Delta(3)-Carene, delta(sup 3)-Carene, DELTA3-Carene, Car-3-ene, (+-)-delta3-Carene, (+)Car-3-ene, (+-)-3-Carene, 3-CARENE (DELTA), 3-Norcarene, 3,7,7-trimethyl-, CHEBI:35661, EINECS 236-719-3, 3,7,7-Trimethylbicyclo[4.1.0]hept-3-ene, BRN 1902766, 3,7,7-Trimethylbicyclo(4.1.0)hept-3-ene

Molecular Formula: C10H16Molecular Weight: 136.234040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: BQOFWKZOCNGFEC-UHFFFAOYSA-N

• Diphenylmethylene Glycine Ethyl Ester
IUPAC Name: ethyl 2-[di(phenyl)methylideneamino]acetate | CAS Registry Number: 69555-14-2
Synonyms: TimTec1_000215, Oprea1_254719, 43121_FLUKA, 222542_SIAL, Ethyl (diphenylmethylenamino)acetate, Ethyl [(diphenylmethylene)amino]acetate, CID319508, N-(Diphenylmethylene)glycine ethyl ester, NSC263808, ZINC00055052, NCGC00175354-01, ST002543

Molecular Formula: C17H17NO2Molecular Weight: 267.322380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QUGJYNGNUBHTNS-UHFFFAOYSA-N

• Ethyl (1r,2s)-Cis-2-Hydroxycyclohexanecarboxylate
IUPAC Name: ethyl (1R,2S)-2-hydroxycyclohexane-1-carboxylate | CAS Registry Number: 61586-78-5
Synonyms: ST50307321, Ethyl (1R,2S)-cis-2-hydroxycyclohexanecarboxylate, 6149-52-6, Ethyl cis-2-hydroxy-1-cyclohexanecarboxylate, CIS-ETHYL 2-HYDROXY-CYCLOHEXANECARBOXYLATE, AC1LOR37, SureCN3343793, 17887_ALDRICH, 17887_FLUKA, CTK5B3328, MolPort-003-824-851, ZINC01081421, AG-G-24150, KB-50596, ethyl (2S,1R)-2-hydroxycyclohexanecarboxylate, ethyl (1R,2S)-2-hydroxycyclohexane-1-carboxylate, Cis-2-Hydroxy-cyclohexanecarboxylic acid ethyl ester, ethyl ((1r,2s)-cis-2-hydroxycyclohexanecarboxylate, S14-2263

Molecular Formula: C9H16O3Molecular Weight: 172.221540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: WOGRTPJVNNCUKN-SFYZADRCSA-N

• Ethyl (1r,2s)-Cis-2-Hydroxycyclopentanecarboxylate
IUPAC Name: ethyl (1R,2S)-2-hydroxycyclopentane-1-carboxylate | CAS Registry Number: 61586-79-6
Synonyms: 2-Hydroxy-cyclopentanecarboxylic acid ethyl ester, cis, ST50824681, (1R,2S)-Ethyl 2-hydroxycyclopentanecarboxylate, 2315-21-1, Ethyl (1R,2S)-cis-2-hydroxycyclopentanecarboxylate, AC1MC5DN, SureCN1611565, 55170_ALDRICH, 55170_FLUKA, CTK4F0988, MolPort-003-824-850, ACN-S001993, ANW-60487, ZINC00395635, AKOS015910933, AG-E-67293, AK-96656, KB-50597, KB-77213, FT-0626255

Molecular Formula: C8H14O3Molecular Weight: 158.194960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: IIFIGGNBUOZGAB-RQJHMYQMSA-N

• Ethyl (1S,2S)-Trans-2-Hydroxycyclohexanecarboxylate
IUPAC Name: ethyl (1S,2S)-2-hydroxycyclohexane-1-carboxylate | CAS Registry Number: 29569-79-7
Synonyms: Ethyl (1S,2S)-trans-2-hydroxycyclohexanecarboxylate, Ethyl trans-2-hydroxycyclohexanecarboxylate, 2-Hydroxy-cyclohexanecarboxylic acid ethyl ester, trans, 6125-55-9, trans-2-hydroxy-cyclohexanecarboxylic acid ethyl ester, AC1LOR35, SureCN4569123, 89472_ALDRICH, 89472_FLUKA, SPB-20017, ZINC01081420, ethyl trans-2-hydroxy-1-cyclohexanecarboxylate, A833126, ethyl (1S,2S)-2-hydroxycyclohexane-1-carboxylate, ethyl (1S,2S)-2-oxidanylcyclohexane-1-carboxylate, (1S,2S)-2-hydroxy-1-cyclohexanecarboxylic acid ethyl ester

Molecular Formula: C9H16O3Molecular Weight: 172.221540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: WOGRTPJVNNCUKN-YUMQZZPRSA-N

• Ethyl (1S,2S)-Trans-2-Hydroxycyclopentanecarboxylate
IUPAC Name: ethyl (1S,2S)-2-hydroxycyclopentane-1-carboxylate | CAS Registry Number: 122331-03-7
Synonyms: SureCN8970323, (1S,2S)-TRANS-2-HYDROXY-CYCLOPENTANECARBOXYLIC ACID ETHYL ESTER, SPB-20015, Ethyl (1S,2S)-trans-2-hydroxycyclopentanecarboxylate

Molecular Formula: C8H14O3Molecular Weight: 158.194960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: IIFIGGNBUOZGAB-BQBZGAKWSA-N

• Ethyl Hydrogen Suberate
IUPAC Name: 8-ethoxy-8-oxooctanoic acid | CAS Registry Number: 14113-01-0
Synonyms: Ethyloctanedioic acid, Ethyl hydrogen suberate, Octanedioic acid, ethyl-, EINECS 237-968-0, 68171-34-6

Molecular Formula: C10H18O4Molecular Weight: 202.247520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: KCFVQEAPUOVXTH-UHFFFAOYSA-N

• Ethyl(S)-3-Hydroxybutyrate
IUPAC Name: ethyl 3-hydroxybutanoate | CAS Registry Number: 56816-01-4
Synonyms: Ethyl 3-hydroxybutyrate, Ethyl 3-hydroxybutanoate, Ethyl beta-hydroxybutyrate, Ethyl (1)-3-hydroxybutyrate, Ethyl dl-3-hydroxybutyrate, FEMA No. 3428, Butyric acid, 3-hydroxy-, ethyl ester, Butanoic acid, 3-hydroxy-, ethyl ester, E30603_ALDRICH, Ethyl (S)-3-hydroxybutyrate, W342807_ALDRICH, Ethyl 3-hydroxybutyrate (natural), NSC 8115, 54950_FLUKA, EINECS 226-456-2, EINECS 252-642-8, NSC8115, NSC 42916, NSC42916, EINECS 260-393-1

Molecular Formula: C6H12O3Molecular Weight: 132.157680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OMSUIQOIVADKIM-UHFFFAOYSA-N

• Fingolimod Hcl
IUPAC Name: 2-amino-2-[2-(4-octylphenyl)ethyl]propane-1,3-diol hydrochloride | CAS Registry Number: 162359-56-0
Synonyms: Fingolimod hydrochloride, Fty-720, Fty 720, FTY720, C19H33NO2.HCl, FTY-720A, Fingolimod hydrochloride [USAN], CID107969, Fingolimod hydrochloride (JAN/USAN), IN1328, LS-120139, D04187, 1,3-Propanediol, 2-amino-2-(2-(4-octylphenyl)ethyl)-, hydrochloride, 2-Amino-2-(2-(4-octylphenyl)ethyl)-1,3-propanediol hydrochloride, 2-Amino-2-(2-(4-octylphenyl)ethyl)propane-1,3-diol, HCl

Molecular Formula: C19H34ClNO2Molecular Weight: 343.931760 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 3

InChIKey: SWZTYAVBMYWFGS-UHFFFAOYSA-N

• Fmoc-Ser-(GalNAc(Ac)3-alpha-D)-OH
IUPAC Name: (2S)-3-[(2S,3R,4R,5R,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid | CAS Registry Number: 120173-57-1
Synonyms: SureCN1737629, CTK8E7119, Fmoc-Ser-(Ac3AcNH-|A-Gal)-OH, Fmoc-L-Ser(alpha-D-GalNAc(Ac)3)-OH, FT-0642936, Fmoc-Ser(2-acetamido-3,4,6,-tri-O-acetyl-2-deoxy-|A-D-galactopyranosyl)-OH, N-Fmoc-O-[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-|A-D-galactopyranosyl]-L-serine, N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-O-[3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-|A-D-galactopyranosyl]-L-serine

Molecular Formula: C32H36N2O13Molecular Weight: 656.633840 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 13

InChIKey: ORICVOOXZDVFIP-VOZJJELXSA-N

• Fmoc-Thr(galnac(Ac)3-alpha-D)-OH
IUPAC Name: (2S,3R)-3-[(3R,4R,5R,6R)-3-acetamido-4,5-diacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxy-2-(9H-fluoren-9-ylmethoxycarbonylamino)butanoic acid | CAS Registry Number: 116783-35-8
Synonyms: CTK8E7121, (N-alpha-Fmoc-O-beta-(2-acetamido-2-deoxy-3,4,6-tri-O-acetyl-alpha-D-galactopyranosyl)-L-threonine)

Molecular Formula: C33H38N2O13Molecular Weight: 670.660420 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 13

InChIKey: OXLCJWGAUPPZQJ-QEUXFNCLSA-N

• Heptanedioic acid monoethyl ester
IUPAC Name: 7-ethoxy-7-oxoheptanoic acid | CAS Registry Number: 33018-91-6
Synonyms: Monoethyl Pimelate, Ethyl Hydrogen Pimelate, Pimelic Acid Monoethyl Ester, EINECS 251-346-6, MolPort-000-160-294, Ethyl hydrogen heptane-1,7-dioate, CID118383, P1244

Molecular Formula: C9H16O4Molecular Weight: 188.220940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: NQYXFXWKKYGBNL-UHFFFAOYSA-N

• Histamine
IUPAC Name: (2R)-1-(1H-imidazol-5-yl)propan-2-amine | CAS Registry Number: 75614-87-8
Synonyms: Alpha Methylhistamine, Tocris-0569, (R)-alpha-Methylhistamine, Lopac0_000618, C6H11N3, alpha-methylhistamine, (R)-isomer, PDSP1_000535, PDSP1_000541, PDSP1_000542, PDSP2_000507, PDSP2_000533, PDSP2_000539, NCGC00024656-01, NCGC00024656-02, NCGC00024656-03, LS-177199, LS-191796, 1H-Imidazole-4-ethanamine, alpha-methyl-, (alphaR)-, Histamine, R(-)-alpha-methyl-, dihydrochloride

Molecular Formula: C6H11N3Molecular Weight: 125.171640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: XNQIOISZPFVUFG-RXMQYKEDSA-N

• Mefloquine
IUPAC Name: (S)-[2,8-bis(trifluoromethyl)quinolin-4-yl]-[(2R)-piperidin-2-yl]methanol | CAS Registry Number: 53230-10-7
Synonyms: mefloquine, Lariam, Mefloquin, Mefloquina, Mefloquinum, Mephloquine, Racemic mefloquine, (-)-Mefloquine, nchembio.215-comp3, nchembio.87-comp20, Mefloquinum [INN-Latin], Mefloquina [INN-Spanish], HSDB 6853, Mefloquine [USAN:INN:BAN], UNII-TML814419R, C17H16F6N2O, CHEBI:403542, AIDS008727, (-)-(11S,2'R)-erythro-Mefloquine, AIDS-008727

Molecular Formula: C17H16F6N2OMolecular Weight: 378.312159 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 9

InChIKey: XEEQGYMUWCZPDN-DOMZBBRYSA-N

• Methyl (R)-(+)-2,2,-dimethyl-1,3-dioxolan-4-carboxylate
IUPAC Name: methyl (4R)-2,2-dimethyl-1,3-dioxolane-4-carboxylate | CAS Registry Number: 52373-72-5
Synonyms: Methyl (R)-(+)-2,2-dimethyl-1,3-dioxolane-4-carboxylate, methyl (4R)-2,2-dimethyl-1,3-dioxolane-4-carboxylate, (R)-2,2-Dimethyl-[1,3]dioxolane-4-carboxylic acid methyl ester, (R)-(+)-2,2-Dimethyl-1,3-dioxolane-4-carboxylic Acid Methyl Ester, 2,2-dimethyl-(4R)-1,3-dioxolane-4-carboxylic acid methyl ester, PubChem7064, AC1LGWU9, (R)-methyl 2,2-dimethyl-1,3-dioxolane-4-carboxylate, SureCN877770, Methyl(R)-(+)-2,2-Dimethyl-1,3-dioxolane-4-carboxylate, KSC595Q2D, 345482_ALDRICH, CTK4J5821, DOWWCCDWPKGNGX-RXMQYKEDSA-, MolPort-000-003-495, ANW-31450, ZINC00389654, AKOS015842237, AKOS015910913, AG-F-78435

Molecular Formula: C7H12O4Molecular Weight: 160.167780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: DOWWCCDWPKGNGX-RXMQYKEDSA-N

• Methyl 2-(2-Bromophenyl)Acetate
IUPAC Name: methyl 2-(2-bromophenyl)acetate | CAS Registry Number: 57486-69-8
Synonyms: methyl 2-(2-bromophenyl)acetate, Methyl 2-Bromophenylacetate, methyl2-Bromophenylacetate, AG-G-02878, Benzeneacetic acid,2-bromo-, methyl ester, ZINC06731807, AC1OYI0J, SureCN965852, ACMC-1B1Y6, CTK5A6948, MolPort-001-768-238, AB3930, ANW-32730, SPB-80077, AKOS015835165, AB42488, RP05489, AK114701, KB-53665, AB1008503

Molecular Formula: C9H9BrO2Molecular Weight: 229.070560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: AMVCFIFDMKEIRE-UHFFFAOYSA-N

• Methyl 2-Amino-4-(trifluoromethyl)benzoate
IUPAC Name: methyl 2-amino-4-(trifluoromethyl)benzoate | CAS Registry Number: 61500-87-6
Synonyms: methyl 2-amino-4-(trifluoromethyl)benzoate, 2-AMINO-4-TRIFLUOROMETHYL-BENZOIC ACID METHYL ESTER, AG-G-24172, SureCN1451351, PHARMABRIDGE P-1351, AC1Q42H9, CTK5B3334, MolPort-003-885-805, WT155, ACT09519, ANW-50426, CK1200, ZINC08699307, AKOS015920016, AS02468, MCULE-2501121450, AK-39532, BR-39532, methyl 2-azanyl-4-(trifluoromethyl)benzoate, AM20061160

Molecular Formula: C9H8F3NO2Molecular Weight: 219.160530 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: DZICUHOFOOPVFM-UHFFFAOYSA-N

• Methyl 3-hydroxybutanoate
IUPAC Name: methyl 3-hydroxybutanoate | CAS Registry Number: 3976-69-0
Synonyms: Methyl 3-hydroxybutyrate, Methyl-3-hydroxybutyrate, Methyl (R)-3-hydroxybutyrate, Methyl (S)-3-hydroxybutyrate, EINECS 216-068-1, Methyl (S)-(+)-3-hydroxybutyrate, (R)-(-)-Methyl 3-hydroxybutyrate, EINECS 223-610-0, EINECS 258-628-8, Methyl (R)-(-)-3-hydroxybutyrate, BUTYRIC ACID, 3-HYDROXY-, METHYL ESTER, Butanoic acid, 3-hydroxy-, methyl ester, LS-48063, Butanoic acid, 3-hydroxy-, methyl ester, (S)-, 1487-49-6, 53562-86-0

Molecular Formula: C5H10O3Molecular Weight: 118.131100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LDLDJEAVRNAEBW-UHFFFAOYSA-N

• Methyl 6-aminonicotinate
IUPAC Name: methyl 6-aminopyridin-1-ium-3-carboxylate | CAS Registry Number: 36052-24-1
Synonyms: ZINC00167664, CID6933770

Molecular Formula: C7H9N2O2+Molecular Weight: 153.158560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JACPDLJUQLKABC-UHFFFAOYSA-O

• Miltefosin
IUPAC Name: hexadecyl 2-(trimethylazaniumyl)ethyl phosphate | CAS Registry Number: 58066-85-6
Synonyms: Miltefosine, Miltex, Miltefosin C, Impavido, Hexadecylphosphocholine, HDPC, HePC, Miltefosine (INN), Hexadecylphosphorylcholine, n-Hexadecylphosphorylcholine, Miltefosinum [INN-Latin], Miltefosina [INN-Spanish], Miltefosine [BAN:INN], Miltefosine [INN:BAN], 1-Hexadecylphosphorylcholine, Baxter brand of miltefosine, Prasfarma brand of miltefosine, SPECTRUM1505329, NSC605583, C15H32.C7H17NO4P

Molecular Formula: C21H46NO4PMolecular Weight: 407.568001 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: PQLXHQMOHUQAKB-UHFFFAOYSA-N

• N-Boc-propargylamine
IUPAC Name: tert-butyl N-prop-2-ynylcarbamate | CAS Registry Number: 92136-39-5
Synonyms: N-Boc-prop-2-ynylamine, B2432G1

Molecular Formula: C8H13NO2Molecular Weight: 155.194320 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: DSPYCWLYGXGJNJ-UHFFFAOYSA-N

• N-tert-Butoxycarbonyl-4-piperidinecarbonitrile
IUPAC Name: tert-butyl 4-cyanopiperidine-1-carboxylate | CAS Registry Number: 91419-52-2
Synonyms: 1-Boc-4-cyanopiperidine, 1-N-Boc-4-cyanopiperidine, ZINC01436283, CID1514443, tert-butyl 4-cyano-1-piperidinecarboxylate, TL8005862

Molecular Formula: C11H18N2O2Molecular Weight: 210.272820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: UQADQTBQNVARAP-UHFFFAOYSA-N

• O-Chlorophenylurea
IUPAC Name: (2-chlorophenyl)urea | CAS Registry Number: 114-38-5
Synonyms: 2-Chlorophenylurea, (o-Chlorophenyl)urea, ortho-Chlorophenylurea, Urea, (o-chlorophenyl)-, o-CHLOROPHENYLUREA, Urea, (2-chlorophenyl)-, 1-(2-chlorophenyl)urea, (2-CHLOROPHENYL)UREA, CID8236, Urea, (o-chlorophenyl)- (8CI), NSC42111, NSC 42111, STK350560, ZINC01674997, AI3-20196, T0400-0277

Molecular Formula: C7H7ClN2OMolecular Weight: 170.596280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: ASPIQYFYSMQBHA-UHFFFAOYSA-N

• Phenylacetic hydrazide
IUPAC Name: 2-phenylacetohydrazide | CAS Registry Number: 937-39-3
Synonyms: 2-Phenylacetohydrazide, Phenylacetylhydrazine, Phenylacethydrazide, Phenylacetohydrazide, Phenylacetyl hydrazide, Benzeneacetic acid, hydrazide, Phenylacetic acid hydrazide, Phenacetic acid hydrazide, (2-Phenylacetyl)hydrazine, Phenylacetic acid, hydrazide, Oprea1_206017, P16656_ALDRICH, Acetic acid, phenyl-, hydrazide, ARONIS020480, AIDS058513, AIDS-058513, ALBB-001037, CID70301, EINECS 213-328-6, NSC151437

Molecular Formula: C8H10N2OMolecular Weight: 150.177800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: FPTCVTJCJMVIDV-UHFFFAOYSA-N

• Phosphinic acid,P-phenyl-,ethyl ester
IUPAC Name: ethoxy-oxo-phenylphosphanium | CAS Registry Number: 2511-09-3
Synonyms: Ethyl phenylphosphinate, O-Ethyl phenylphosphinate, WLN: OPHR&O2, Phenylphosphinic acid ethyl ester, 415642_ALDRICH, Phosphinic acid, phenyl-, ethyl ester, NSC 300841, NSC300841, CID6328020, LS-106209

Molecular Formula: C8H10O2P+Molecular Weight: 169.137561 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: YJSXLGKPMXKZJR-UHFFFAOYSA-N

• Pyrazol-1-Yl-Methanol
IUPAC Name: pyrazol-1-ylmethanol | CAS Registry Number: 1120-82-7
Synonyms: Pyrazole-1-methanol, NSC50562, CID242224, ZINC01682023, I14-4441, InChI=1/C4H6N2O/c7-4-6-3-1-2-5-6/h1-3,7H,4H

Molecular Formula: C4H6N2OMolecular Weight: 98.103240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BYUMAPPWWKNLNX-UHFFFAOYSA-N

• Pyrimidine, 2-chloro-4-(3-pyridinyl)-
IUPAC Name: 2-chloro-4-pyridin-3-ylpyrimidine | CAS Registry Number: 483324-01-2
Synonyms: 2-chloro-4-pyridin-3-yl-pyrimidine, 2-chloro-4-(pyridin-3-yl)pyrimidine, 4-(3-Pyridyl)-2-chloropyrimidine, 4-(3 -pyridyl)-2-chloropyrimidine, PubChem24125, AGN-PC-00GJ6U, MolPort-002-053-017, 2-Chloro-4-(3-pyridyl)pyrimidine, ACN-S001750, AMX10174, 4-(3'-pyridyl)-2-chloropyrimidine, SPB-80350, AKOS006331297, QC-5723, AK113479, AB1008517, KB-169781, KB-186825, A22144

Molecular Formula: C9H6ClN3Molecular Weight: 191.617040 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MGQROXOMFRGAOY-UHFFFAOYSA-N

• Salmeterol Xinafoate
IUPAC Name: 2-(hydroxymethyl)-4-[1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl]phenol; 1-hydroxynaphthalene-2-carboxylic acid | CAS Registry Number: 94749-08-3
Synonyms: Serevent, salmeterol xinafoate, Salmetedur, Asmerole, Betamican, Ultrabeta, Dilamax, Inaspir, Beglan, Arial, Serevent diskus, Serevent (TN), Serevent Inhaler and Disks, GR 33343X xinafoate, Salmeterol xinafoate [USAN], Advair Diskus 100/50, Advair Diskus 250/50, Advair Diskus 500/50, MLS001332577, MLS001332578

Molecular Formula: C36H45NO7Molecular Weight: 603.745000 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 8

InChIKey: XTZNCVSCVHTPAI-UHFFFAOYSA-N

• Sebacic Acid Monomethyl Ester
IUPAC Name: 10-methoxy-10-oxodecanoic acid | CAS Registry Number: 818-88-2
Synonyms: Mono-methyl sebacate, Sebacic acid monomethyl ester, Methyl hydrogen sebacate, Decanoic acid, monomethyl ester, MEGxp0_000858, 10-Methoxy-10-oxodecanoic acid, ACon1_002146, CID69957, EINECS 212-458-0, STK378739, DAH1599450, NCGC00179784-01, AI3-11759

Molecular Formula: C11H20O4Molecular Weight: 216.274100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OSYQOBUUFRGFNG-UHFFFAOYSA-N

• tert-Butoxycarbonyl-L-valine N-hydroxysuccinimide ester
IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate | CAS Registry Number: 3392-12-9
Synonyms: MolPort-003-917-838, NSC164060, CID294911

Molecular Formula: C14H22N2O6Molecular Weight: 314.334280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: POBDBYGSGKMZPH-UHFFFAOYSA-N

• Tert-butoxycarbonylamino-phenyl-acetic Acid
IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylacetic acid | CAS Registry Number: 3601-66-9
Synonyms: Boc-phenylglycine, CID571805, tert-Butoxycarbonylamino-phenyl-acetic acid, FS000066, ST5210539

Molecular Formula: C13H17NO4Molecular Weight: 251.278380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: HOBFSNNENNQQIU-UHFFFAOYSA-N

• 1-Deoxynojirimycin Hydrochloride
IUPAC Name: (2R,3R,4R,5S)-2-(hydroxymethyl)piperidine-3,4,5-triol;hydrochloride | CAS Registry Number: 73285-50-4
Synonyms: 1-Deoxynojirimycin hydrochloride, AT-2220, 1,5-Dideoxy-1,5-imino-D-sorbitol hydrochloride, Duvoglustat hydrochloride, Deoxynojirimycin hydrochloride, 1-Deoxy-L-altronojirimycin Hydrochloride, 355138-93-1, Moranolin hydrochloride, DNJ, SureCN1320203, D9305_SIGMA, CHEMBL460785, BAY-h-5595, 31128_FLUKA, CTK8F0904, HGT-3510, SPB-80461, SC-48305, FT-0624514, D09606

Molecular Formula: C6H14ClNO4Molecular Weight: 199.632660 [g/mol]
H-Bond Donor: 6H-Bond Acceptor: 5

InChIKey: ZJIHMALTJRDNQI-VFQQELCFSA-N

• 4-Chloro-3-Hydroxy Butyronitrile
IUPAC Name: 4-chloro-3-hydroxybutanenitrile | CAS Registry Number: 105-33-9
Synonyms: 4-Chloro-3-hydroxybutyronitrile, 4-Chloro-3-hydroxy-butyronitrile, Butanenitrile, 4-chloro-3-hydroxy-, EINECS 203-287-2, gamma-Chloro-beta-hydroxybutyronitrile, AI3-28758, 637-75-2

Molecular Formula: C4H6ClNOMolecular Weight: 119.549540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LHBPNZDUNCZWFL-UHFFFAOYSA-N

• 4-(aminomethyl)benzyl Alcohol
IUPAC Name: [4-(aminomethyl)phenyl]methanol | CAS Registry Number: 39895-56-2
Synonyms: 4-Aminomethylbenzyl alcohol, [4-(aminomethyl)phenyl]methanol, (4-(Aminomethyl)phenyl)methanol, 4-aminomethylbenzylalcohol, 4-(Aminomethyl)benzyl alcohol, (4-Aminomethyl-phenyl)-methanol, [4-(aminomethyl)phenyl]methan-1-ol, SBB052367, ASN 13654843, AC1O6ADP, SureCN216928, (4-Aminomethylphenyl)-methanol, MolPort-000-128-031, HMS1704B11, ANW-49154, AKOS000732764, AB23442, AG-C-01999, AG-L-63955, RP20369

Molecular Formula: C8H11NOMolecular Weight: 137.179040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: WMOUKOAUAFESMR-UHFFFAOYSA-N

• (2-amino-phenyl)-carbamic Acid Tert-butyl Ester
IUPAC Name: tert-butyl N-(2-aminophenyl)carbamate | CAS Registry Number: 146651-75-4
Synonyms: Tert-butyl (2-aminophenyl)carbamate, tert-butyl 2-aminophenylcarbamate, tert-butyl N-(2-aminophenyl)carbamate, Carbamic acid,N-(2-aminophenyl)-, 1,1-dimethylethyl ester, N-(2-aminophenyl)(tert-butoxy)carboxamide, (2-Amino-phenyl)-carbamic Acid Tert-butyl Ester, ZINC00039322, AC1LDWCH, PubChem14771, ACMC-1BYOR, SureCN211033, AC1Q1N9Q, N-Boc-1,2-phenylenediamine, Oprea1_110611, Mono-N-Boc-o-phenylenediamine, 681687_ALDRICH, CTK4C5040, MolPort-001-756-528, ANW-50268, SBB000475

Molecular Formula: C11H16N2O2Molecular Weight: 208.256940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: KCZFBLNQOSFGSH-UHFFFAOYSA-N

• 4-benzyloxyphenylhydrazine Hydrochloride
IUPAC Name: (4-phenylmethoxyphenyl)hydrazine hydrochloride | CAS Registry Number: 52068-30-1
Synonyms: EINECS 257-636-9, 4-Benzyloxyphenylhydrazine hydrochloride, D1259, (4-(Benzyloxy)phenyl)hydrazine monohydrochloride

Molecular Formula: C13H15ClN2OMolecular Weight: 250.724000 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: OVNUPJXMCMTQCN-UHFFFAOYSA-N


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