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• 1-nonene
IUPAC Name: non-1-ene | CAS Registry Number: 124-11-8
Synonyms: 1-NONENE, n-Non-1-ene, alpha-Nonene, Propylene trimer, Nonene (petroleum), NONYLENE, 1-N-None, Alkenes, C6-12 alpha-, Alkenes, C8-1O, C9-rich, (C6-C12) alpha-Olefin, Alkenes, C8-10, C9-rich, NCIOpen2_000424, N30404_ALDRICH, 74323_FLUKA, EINECS 271-212-0, HSDB 1081, NSC73961, EINECS 204-681-7, EINECS 272-491-1, NSC 73961

Molecular Formula: C9H18Molecular Weight: 126.239220 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: JRZJOMJEPLMPRA-UHFFFAOYSA-N

• 1-pentyne
IUPAC Name: pent-1-yne | CAS Registry Number: 627-19-0
Synonyms: 1-PENTYNE, Acetylene, propyl-, pent-1-yne, 256560_ALDRICH, 77050_FLUKA, EINECS 210-987-1, AI3-37709, TL8004247, InChI=1/C5H8/c1-3-5-4-2/h1H,4-5H2,2H

Molecular Formula: C5H8Molecular Weight: 68.117020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: IBXNCJKFFQIKKY-UHFFFAOYSA-N

• 1-propynyl-1-cyclohexanol
IUPAC Name: 1-prop-1-ynylcyclohexan-1-ol | CAS Registry Number: 697-37-0
Synonyms: 1-prop-1-ynyl-cyclohexan-1-ol, NSC25110, SBB008936, ZINC01620945

Molecular Formula: C9H14OMolecular Weight: 138.206860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UTISCLIDFORRJP-UHFFFAOYSA-N

• 1-tridecene
IUPAC Name: tridec-1-ene | CAS Registry Number: 2437-56-1
Synonyms: 1-TRIDECENE, N-Tridec-1-ene, Undecylethylene, Tridecylene, Tridecene, alpha-Tridecene, tridec-1-ene, CCRIS 5719, T57703_ALDRICH, HSDB 1088, 479810_ALDRICH, 91578_FLUKA, EINECS 219-443-8, NSC 78473, CID17095, NSC78473, BRN 1744660, SBB009033, LS-157166, 4-01-00-00921 (Beilstein Handbook Reference)

Molecular Formula: C13H26Molecular Weight: 182.345540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: VQOXUMQBYILCKR-UHFFFAOYSA-N

• 2,2',2-terpyridine
IUPAC Name: 2,6-di(pyridin-2-yl)pyridine | CAS Registry Number: 1148-79-4
Synonyms: Tripyridyl, Tripyridine, 2,2',2''-Terpyridyl, 2,2',2''-Tripyridyl, 2,2',2''-Terpyridine, 2,2':6',2''-Terpyridine, 2,2'2''-Tripyridyl, 2,6-Bis(2-pyridyl)pyridine, Enamine_000115, NCIMech_000074, 2,2',2''-Tripyridine, 2,2',6',2 -Terpyridine, 2,2':6',2"-Terpyridine, CCRIS 3429, 2,6-Di(2-pyridyl)pyridine, Ba 2799, MLS000048666, NSC3905, 234672_ALDRICH, 2,6-Di(pyridin-2-yl)pyridine

Molecular Formula: C15H11N3Molecular Weight: 233.267940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DRGAZIDRYFYHIJ-UHFFFAOYSA-N

• 2,4,6-tri(2-pyridyl)-1,3,5-triazine
IUPAC Name: 2,4,6-tri(pyridin-2-yl)-1,3,5-triazine | CAS Registry Number: 3682-35-7
Synonyms: Terpyridyl-s-triazine, TPTZ (iron reagent), TPTZ, Tri-2-pyridyl-s-triazine, 2,4,6-Tripyridyl-s-triazine, s-Triazine, tri-2-pyridyl-, 2,4,6-Tri(2-pyridyl)-s-triazine, 2,4,6-Tris(2-pyridyl)-s-triazine, MLS000737726, T1253_SIGMA, 2,4,6-Tripyridyl-1,3,5-triazine, 2,4,6-Tris(2-pyridyl)-5-triazine, s-Triazine, 2,4,6-tri-2-pyridyl-, 93285_FLUKA, EINECS 222-965-9, NSC 112125, BRN 0282581, 2,4,6-Tris(2-pyridyl)-1,3,5-triazine, NSC112125, SBB005932

Molecular Formula: C18H12N6Molecular Weight: 312.328080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: KMVWNDHKTPHDMT-UHFFFAOYSA-N

• 2,4-hexadiyn-1,6-diol
IUPAC Name: hexa-2,4-diyne-1,6-diol | CAS Registry Number: 3031-68-3
Synonyms: Diacetylene glycol, 2,4-Hexadiynediol, 2,4-Hexadiyne-1,6-diol, 2,4-Hexadiyn-1,6-diol, Hexa-2,4-diyne-1,6-diol, 52490_FLUKA, NSC11686, EINECS 221-210-0, NSC 11686, SBB008793, ZINC01718504

Molecular Formula: C6H6O2Molecular Weight: 110.110640 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: JXMQYKBAZRDVTC-UHFFFAOYSA-N

• 2-bromopropene
IUPAC Name: 2-bromoprop-1-ene | CAS Registry Number: 557-93-7
Synonyms: Isopropenyl bromide, 2-Bromopropylene, Propene, 2-bromo-, 2-BROMOPROPENE, 2-Bromo-1-propene, Isopropylene bromide, 1-Propene, 2-bromo-, 2-bromoprop-1-ene, alpha-Methylvinyl bromide, .alpha.-Methylvinyl bromide, B78254_ALDRICH, EINECS 209-185-4, NSC 87535, CID11202, NSC87535, BRN 1731926, LS-123450, InChI=1/C3H5Br/c1-3(2)4/h1H2,2H, 4-01-00-00754 (Beilstein Handbook Reference)

Molecular Formula: C3H5BrMolecular Weight: 120.975800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: PHMRPWPDDRGGGF-UHFFFAOYSA-N

• (1R)-(+)-3-Bromocamphor-8-sulfonic acid ammonium salt
IUPAC Name: azanium [(1R,3S,4S)-3-bromo-1,7-dimethyl-2-oxo-7-bicyclo[2.2.1]heptanyl]methanesulfonate | CAS Registry Number: 14575-84-9
Synonyms: D-alpha-BROMOCAMPHOR-PI-SULFONIC, NH(4) SALT

Molecular Formula: C10H18BrNO4SMolecular Weight: 328.223220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: GFBVBBRNPGPROZ-ATNBVHDLSA-N

• 2',3',5'-Triacetylinosine
IUPAC Name: [4-acetyloxy-5-(acetyloxymethyl)-2-(6-oxo-3H-purin-9-yl)oxolan-3-yl] acetate | CAS Registry Number: 3181-38-2
Synonyms: NCIOpen2_008118, NCIOpen2_009732, Oprea1_659478, CBDivE_001623, NSC66386, NSC83296, NSC90329, NSC97105, CID248866, ZINC03881716, NCGC00096125-01, BAS 00485773, ST012368, ST5231885, EU-0070580, 28069-16-1, 63248-71-5

Molecular Formula: C16H18N4O8Molecular Weight: 394.336120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 11

InChIKey: SFEQTFDQPJQUJM-UHFFFAOYSA-N

• 2,7-Diaminofluorene dihydrochloride
IUPAC Name: 9H-fluorene-2,7-diamine | CAS Registry Number: 13548-69-1
Synonyms: 2,7-Diaminofluorene, 2,7-Fluorenediamine, 2,7-Fluoroenediamine, 9H-Fluorene-2,7-diamine, FLUORENE-2,7-DIAMINE, Fluorene-2,7-diyldiamine, CCRIS 920, Oprea1_360365, D17106_ALDRICH, 32980_FLUKA, EINECS 208-377-5, NSC 12277, WLN: L B656 HHJ EZ KZ, 9H-Fluorene-2,7-diamine (9CI), NSC12277, ZINC00248774, AI3-50463, LS-69252, TL8000831, 525-64-4

Molecular Formula: C13H12N2Molecular Weight: 196.247780 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: SNCJAJRILVFXAE-UHFFFAOYSA-N

• (S)-(+)-2-(9-Fluorenylmethoxycarbonyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid
IUPAC Name: (3S)-2-(9H-fluoren-9-ylmethoxycarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate | CAS Registry Number: 136030-33-6
Synonyms: ZINC00621966, ZINC00621968, CID6957976

Molecular Formula: C25H20NO4-Molecular Weight: 398.430600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: LIRBCUNCXDZOOU-QHCPKHFHSA-M

• 2-Chloro-1-methylpyridinium iodide
IUPAC Name: 2-chloro-1-methylpyridin-1-ium iodide | CAS Registry Number: 14338-32-0
Synonyms: 198005_ALDRICH, EINECS 238-288-7, 2-chloro-1-methyl-pyridinium iodide, NSC200739, LS-184963

Molecular Formula: C6H7ClINMolecular Weight: 255.483950 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: ABFPKTQEQNICFT-UHFFFAOYSA-M

• 1-(4-Hydroxyphenyl)-5-mercaptotetrazole
IUPAC Name: 1-(4-hydroxyphenyl)-2H-tetrazole-5-thione | CAS Registry Number: 52431-78-4
Synonyms: H7023_SIGMA, 371599_ALDRICH, ZINC02504589, EINECS 257-909-2, ZINC00156074, CID3034725, 1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol, T5655011, 1,2-Dihydro-1-(p-hydroxyphenyl)-5H-tetrazole-5-thione, 5H-Tetrazole-5-thione, 1,2-dihydro-1-(4-hydroxyphenyl)-

Molecular Formula: C7H6N4OSMolecular Weight: 194.213740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: MOXZSKYLLSPATM-UHFFFAOYSA-N

• 2,6-Dimethoxy-p-benzoquinone
IUPAC Name: 2,6-dimethoxycyclohexa-2,5-diene-1,4-dione | CAS Registry Number: 530-55-2
Synonyms: 2,6-Dimethoxybenzoquinone, 2,6-Dimethoxyquinone, 2,6-Dimethoxy-p-quinone, DMBQ, Spectrum_000723, 2,6-Dimethoxy-1,4-benzoquinone, Maybridge1_002628, Spectrum2_000781, Spectrum3_000177, Spectrum4_001608, Spectrum5_000335, ghl.PD_Mitscher_leg0.4, p-Benzoquinone, 2,6-dimethoxy-, BSPBio_001673, KBioGR_001955, KBioSS_001203, SPECTRUM200413, NSC24500, DivK1c_001380, 2,6-Dimethoxybenzo-1,4-quinone

Molecular Formula: C8H8O4Molecular Weight: 168.146720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OLBNOBQOQZRLMP-UHFFFAOYSA-N

• 2-Chloro-4H-1,3,2-benzodioxaphosphorin-4-one
IUPAC Name: 2-chloro-1,3,2-benzodioxaphosphinin-4-one | CAS Registry Number: 5381-99-7
Synonyms: Salicyl chlorophosphite, 324124_ALDRICH, NSC40209, 23514_FLUKA, CID237010, ST5405930, 2-Chloro-1,3,2-benzodioxaphosphorin-4-one

Molecular Formula: C7H4ClO3PMolecular Weight: 202.531621 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BVOITXUNGDUXRW-UHFFFAOYSA-N

• 2-Acetamidofluorene
IUPAC Name: N-(9H-fluoren-2-yl)acetamide | CAS Registry Number: 53-96-3
Synonyms: N-2-Fluorenylacetamide, 2-Acetylaminofluorene, 2-Fluorenylacetamide, Acetoaminofluorene, 2-Acetaminofluorene, Acetamidofluorene, 2-AAF, Azetylaminofluoren, Fluorenylacetamide, 2-Acetoaminofluorene, 2-Acetylaminfluorene, N-Fluoren-2-ylacetamide, N-acetyl-2-aminofluorene, 2-Aminoacetylfluorene, 2-Fluorenil acetamide, 2 Acetamidofluorene, 2-(Acetylamino)fluorene, ACETYLAMINOFLUORENE, 2 Fluorenylacetamide, Acetamide, N-9H-fluoren-2-yl-

Molecular Formula: C15H13NOMolecular Weight: 223.269820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: CZIHNRWJTSTCEX-UHFFFAOYSA-N

• 4-Methyloctanoic acid
IUPAC Name: 4-methyloctanoic acid | CAS Registry Number: 54947-74-9
Synonyms: Octanoic acid, 4-methyl-, 4-Methylcaprylic acid, 4-methyl-octanoic acid, ()-4-Methyloctanoic acid, W357502_ALDRICH, FEMA No. 3575, EINECS 259-404-2, LMFA01020244, 153831-54-0

Molecular Formula: C9H18O2Molecular Weight: 158.238020 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LEGGANXCVQPIAI-UHFFFAOYSA-N

• (-)-Cotinine
IUPAC Name: 1-methyl-5-pyridin-3-ylpyrrolidin-2-one | CAS Registry Number: 486-56-6
Synonyms: cotinine, Scotine, (S)-Cotinine, Cotinine [INN], (S)-(-)-Cotinine, Cotininum [INN-Latin], Cotinina [INN-Spanish], CCRIS 7625, C10H12N2O, EINECS 207-634-9, NIH 10498, BRN 0083099, 2-Pyrrolidinone, 1-methyl-5-(3-pyridinyl)-, (S)-, NCGC00093739-01, NCGC00093739-02, NCGC00093739-03, NCGC00093739-04, NCGC00093739-05, NCGC00093739-06, NCGC00093739-07

Molecular Formula: C10H12N2OMolecular Weight: 176.215080 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: UIKROCXWUNQSPJ-UHFFFAOYSA-N

• 1-Hydroxyisoquinoline
IUPAC Name: 2H-isoquinolin-1-one | CAS Registry Number: 491-30-5
Synonyms: Isocarbostyril, 1-Isoquinolinol, Isoquinolin-1-one, isoquinolin-1-ol, 1(2H)-ISOQUINOLINONE, 1(2H)-Isoquinolone, Isoquinolin-1(2H)-one, ISOQUINOLIN-12H-ONE, Oprea1_201307, Isocarbostyril (VAN) (8CI), CHEBI:18350, CID10284, NSC27273, EINECS 207-732-1, NSC 27273, SBB004122, ZINC00332651, AI3-62131, ST5163468, C06324

Molecular Formula: C9H7NOMolecular Weight: 145.157980 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: VDBNYAPERZTOOF-UHFFFAOYSA-N

• 1,3-Propanediol
IUPAC Name: propane-1,3-diol | CAS Registry Number: 504-63-2
Synonyms: Trimethylene glycol, 1,3-PROPANEDIOL, Propane-1,3-diol, 2-Deoxyglycerol, omega-Propanediol, 1,3-Dihydroxypropane, 1,3-Propylenediol, beta-Propylene glycol, 1,3-Propylene glycol, 2-(Hydroxymethyl)ethanol, .beta.-Propylene glycol, .omega.-Propanediol, 1,3-PROPANDIOL, P50404_ALDRICH, 533734_ALDRICH, 81780_FLUKA, CHEBI:16109, EINECS 207-997-3, CPD-347, NSC 65426

Molecular Formula: C3H8O2Molecular Weight: 76.094420 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YPFDHNVEDLHUCE-UHFFFAOYSA-N

• 1,3-Dithiane
IUPAC Name: 1,3-dithiane | CAS Registry Number: 505-23-7
Synonyms: m-DITHIANE, 1,3-Dithiacyclohexane, 1,3-dithian, Dithiane-1,3, Dithiane-1,3 [French], CCRIS 6777, 157872_ALDRICH, CHEBI:47845, EINECS 208-006-7, NSC 157830, NSC157830, ZINC03861206, AI3-62288, LS-63109, TL8003353, InChI=1/C4H8S2/c1-2-5-4-6-3-1/h1-4H

Molecular Formula: C4H8S2Molecular Weight: 120.236320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WQADWIOXOXRPLN-UHFFFAOYSA-N

• 2,3-Dibromo-1-propene
IUPAC Name: 2,3-dibromoprop-1-ene | CAS Registry Number: 513-31-5
Synonyms: 2,3-Dibromopropene, 2-Bromoallyl bromide, 2,3-Dibromopropylene, alpha-Epidibromohydrin, Propene, 2,3-dibromo-, 1-Propene, 2,3-dibromo-, 1,2-Dibromo-2-propene, 2,3-DIBROMO-1-PROPENE, .alpha.-Epidibromohydrin, WLN: E1YEU1, CCRIS 6712, 106003_ALDRICH, NSC 6200, 34293_FLUKA, EINECS 208-155-8, NSC6200, Propene, 2,3-dibromo- (8CI), BRN 0878169, AI3-14618, LS-123461

Molecular Formula: C3H4Br2Molecular Weight: 199.871860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: YMFWYDYJHRGGPF-UHFFFAOYSA-N

• 1-Methyladenine
IUPAC Name: 1-methylpurin-6-amine | CAS Registry Number: 5142-22-3
Synonyms: N1-methyladenine, Adenine, 1-methyl-, 6-Amino-1-methylpurine, 1-Methyl-1H-purin-6-amine, 1H-Purin-6-amine, 1-methyl-, 1-Methyl-1H-purin-6-ylamine, NSC70896, CHEBI:18083, AIDS024270, AIDS-024270, EINECS 225-907-0, NSC 70896, ZINC00403050, 1H-Purin-6-amine, 1-methyl- (9CI), 6H-Purin-6-imine, 1,9-dihydro-1-methyl-, 1-methyl-1,9-dihydro-6H-purin-6-imine, WLN: T56 BM DN FYN HNJ FUM H1, ST5298860, 6H-Purin-6-imine, 1, 9-dihydro-1-methyl-, C02216

Molecular Formula: C6H7N5Molecular Weight: 149.153280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: HPZMWTNATZPBIH-UHFFFAOYSA-N

• 2,3,5-Tri-O-benzyl-beta-D-arabinofuranose
IUPAC Name: 3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-ol | CAS Registry Number: 60933-68-8
Synonyms: T8255_SIGMA, NSC81026, NSC232028, 2,3,5-Tri-O-benzyl-D-arabinofuranose

Molecular Formula: C26H28O5Molecular Weight: 420.497520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: NAQUAXSCBJPECG-UHFFFAOYSA-N

• 2-Aminoanthracene
IUPAC Name: anthracen-2-amine | CAS Registry Number: 613-13-8
Synonyms: 2-Anthramine, 2-Anthrylamine, 2-Anthracylamine, 2-ANTHRACENAMINE, 2-Anthracenamide, beta-Aminoanthracene, 1-Aminoanthracene, anthracen-2-amine, .beta.-Aminoanthracene, 2-Anthramine (8CI), CCRIS 22, A38800_ALDRICH, HSDB 4041, WLN: L C666J EZ, 06765_FLUKA, CHEBI:34260, EINECS 210-330-9, AIDS018997, NSC 400535, AIDS-018997

Molecular Formula: C14H11NMolecular Weight: 193.243840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: YCSBALJAGZKWFF-UHFFFAOYSA-N

• 2,5-Diamino Toluene Sulfate
IUPAC Name: 2-methylbenzene-1,4-diamine; sulfuric acid | CAS Registry Number: 615-50-9
Synonyms: Fouramine STD, 2,5-Diaminotoluene sulfate, 2,5-Toluenediamine sulfate, oxidation base 14, CI Oxidation Base 4, C.I. Oxidation Base 4, ox idation base 14, p-Tolylenediamine sulfate, para-Toluenediamine sulphate, Toluene-2,5-diamine, sulfate, P-TOLUENEDIAMINE SULFATE, p-Toluylenediamine sulfate, para-Toluylenediamine sulphate, Toluene-2,5-diamine sulfate, CCRIS 595, para-Toluenediamine sulfate, Toluene-2,5-diamine sulphate, Toluylene-2,5-diamine sulfate, NCI-C01832, Toluylene-2,5-diamine sulphate

Molecular Formula: C7H12N2O4SMolecular Weight: 220.246180 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: KZTWOUOZKZQDMN-UHFFFAOYSA-N

• (R)-(+)-Isobutyl D-lactate
IUPAC Name: 2-methylpropyl 2-hydroxypropanoate | CAS Registry Number: 61597-96-4
Synonyms: Isobutyl lactate, Isobutyl D-lactate, 2-methylpropyl 2-hydroxypropanoate, Propanoic acid, 2-hydroxy-, 2-methylpropyl ester, SBB061172, AG-G-90855, 585-24-0, 73523-02-1, R-(+)-isobutyl lactate, AGN-PC-0D5TIT, AC1L3OW4, AC1Q62ST, Isobutyl 2-hydroxypropanoate, CTK1G8424, MolPort-006-111-942, 2-Methylpropyl 2-hydroxypropionate, 2-methylpropyl 2-oxidanylpropanoate, EINECS 209-551-3, AR-1J2622, AKOS006229869

Molecular Formula: C7H14O3Molecular Weight: 146.184260 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: WBPAQKQBUKYCJS-UHFFFAOYSA-N

• 2,3-Pyrazinedicarboxamide
IUPAC Name: pyrazine-2,3-dicarboxamide | CAS Registry Number: 6164-78-9
Synonyms: Pyrazine der., Pyrazine-2,3-dicarboxamide, P56151_ALDRICH, AIDS070612, 2,3-PYRAZINE DICARBOXAMIDE, 2,3-Pyrazinedicarboxylic acid, diamide, AIDS-070612, NSC93820, EINECS 228-197-0, NSC 93820, ZINC00967329, AI3-61138, ST5406115, AC-907/25014119

Molecular Formula: C6H6N4O2Molecular Weight: 166.137440 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: TZMYZOQDDVSLJU-UHFFFAOYSA-N

• 2,4-Dihydroxypyridine
IUPAC Name: 2-hydroxy-1H-pyridin-4-one | CAS Registry Number: 626-03-9
Synonyms: 3-Deazauracil, 2,4-Pyridinediol, 4-Hydroxy-2-pyridone, 2,4-DIHYDROXYPYRIDINE, pyridine-2,4-diol, 2(1H)-Pyridinone, 4-hydroxy-, 2(1H)-Pyridinone,4-hydroxy, 4-Hydroxy-2(1H)-pyridinone, 2(1H)-Pyridone, 4-hydroxy-, 176974_ALDRICH, NSC37839, 37945_FLUKA, EINECS 210-924-8, NSC 37839, NSC119859, AIDS081856, NSC 119859, AIDS-081856, SBB004331, ZINC03861292

Molecular Formula: C5H5NO2Molecular Weight: 111.098700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: ZEZJPIDPVXJEME-UHFFFAOYSA-N

• 1-(4-Nitrophenyl)piperazine
IUPAC Name: 1-(4-nitrophenyl)piperazine | CAS Registry Number: 6269-89-2
Synonyms: Piperazine, 1-(4-nitrophenyl)-, Oprea1_305105, 1-(4-Nitrophenyl)-piperazine, 279773_ALDRICH, TOS-BB-0562, NSC33874, EINECS 228-443-7, SBB003475, ST5213758, TL8004239, InChI=1/C10H13N3O2/c14-13(15)10-3-1-9(2-4-10)12-7-5-11-6-8-12/h1-4,11H,5-8H

Molecular Formula: C10H13N3O2Molecular Weight: 207.229120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VWOJSRICSKDKAW-UHFFFAOYSA-N

• 1,5-Dichloropentane
IUPAC Name: 1,5-dichloropentane | CAS Registry Number: 628-76-2
Synonyms: Amylene chloride, Pentamethylene dichloride, 1,5-DICHLOROPENTANE, Pentamethylene chloride, Pentane, 1,5-dichloro-, WLN: G5G, D69602_ALDRICH, NSC 6210, EINECS 211-053-6, NSC6210, BRN 1732340, AI3-16489, LS-101617, TL8004300, 4-01-00-00310 (Beilstein Handbook Reference), InChI=1/C5H10Cl2/c6-4-2-1-3-5-7/h1-5H

Molecular Formula: C5H10Cl2Molecular Weight: 141.038900 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: LBKDGROORAKTLC-UHFFFAOYSA-N

• 2-Amino-5-chlorobenzoic acid
IUPAC Name: 2-amino-5-chlorobenzoic acid | CAS Registry Number: 635-21-2
Synonyms: 5-Chloroanthranilic acid, Anthranilic acid, 5-chloro-, Benzoic acid, 2-amino-5-chloro-, 2-AMINO-5-CHLOROBENZOIC ACID, 5-Chloro-2-aminobenzoic acid, A45475_ALDRICH, 378046_ALDRICH, 07360_FLUKA, AIDS020040, AIDS-020040, EINECS 211-230-8, NSC404157, SBB016392, Anthranilic acid, 5-chloro- (8CI), NSC 404157, AI3-15229, TL8004430, InChI=1/C7H6ClNO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,9H2,(H,10,11

Molecular Formula: C7H6ClNO2Molecular Weight: 171.581040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IFXKXCLVKQVVDI-UHFFFAOYSA-N

• 2,6-Dichlorophenylacetic acid
IUPAC Name: 2-(2,6-dichlorophenyl)acetic acid | CAS Registry Number: 6575-24-2
Synonyms: 259241_ALDRICH, Benzeneacetic acid, 2,6-dichloro-, EINECS 229-504-0, SBB003503, 2,6-DICHLOROPHENYL ACETIC ACID, InChI=1/C8H6Cl2O2/c9-6-2-1-3-7(10)5(6)4-8(11)12/h1-3H,4H2,(H,11,12, 2CL

Molecular Formula: C8H6Cl2O2Molecular Weight: 205.038040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SFAILOOQFZNOAU-UHFFFAOYSA-N

• 2-Chloro-3-hydroxypyridine
IUPAC Name: 2-chloropyridin-3-ol | CAS Registry Number: 6636-78-8
Synonyms: 2-Chloro-3-pyridinol, 2-Chloropyridin-3-ol, 3-Pyridinol, 2-chloro-, Ambap3087, WLN: T6NJ BG CQ, 116203_ALDRICH, EINECS 229-635-3, NSC 18469, NSC18469, 2-CHLORO-3-HYDROXY PYRIDINE, BRN 0002216, ZINC00164485, AI3-61989, C181, LS-132991, TL8004704, 5-21-02-00085 (Beilstein Handbook Reference)

Molecular Formula: C5H4ClNOMolecular Weight: 129.544360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RSOPTYAZDFSMTN-UHFFFAOYSA-N

• 5-(6-Aminopurin-9-yl)-2-methyltetrahydrofuran-3-ol
IUPAC Name: (2R,3S,5R)-5-(6-aminopurin-9-yl)-2-methyloxolan-3-ol | CAS Registry Number: 6698-26-6
Synonyms: nchembio.79-comp14, 2',5'-Dideoxyadenosine, 2',5-Dideoxyadenosine, Adenosine, 2',5'-dideoxy-, D7408_SIGMA, NSC 95943, ZINC00040150, ST5309422, DDA

Molecular Formula: C10H13N5O2Molecular Weight: 235.242520 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 7

InChIKey: FFHPXOJTVQDVMO-DSYKOEDSSA-N

• 4-Chloro-2,6-dimethylpyrimidine
IUPAC Name: 4-chloro-6-methylpyrimidin-2-amine | CAS Registry Number: 5600-21-5
Synonyms: AM (inhibitor), AM (pesticide), prepn. AM, AM (nitrification inhibitor), MLS000389365, 2-AMINO-4-CHLORO-6-METHYLPYRIMIDINE, 2-Pyrimidinamine, 4-chloro-6-methyl-, 122882_ALDRICH, NSC 7892, 4-chloro-6-methylpyrimidin-2-amine, EINECS 227-018-3, NSC7892, NSC 23661, 4-Chloro-6-methylpyrimidin-2-ylamine, AIDS020790, Pyrimidine, 2-amino-4-chloro-6-methyl-, AIDS-020790, NSC23661, BRN 0114297, 2-Amino-6-chloro-4-methylpyrimidine

Molecular Formula: C5H6ClN3Molecular Weight: 143.574240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NPTGVVKPLWFPPX-UHFFFAOYSA-N

• 1-Benzyl-4-cyano-4-phenylpiperidine hydrochloride
IUPAC Name: 4-phenyl-1-(phenylmethyl)piperidine-4-carbonitrile | CAS Registry Number: 56243-25-5
Synonyms: Oprea1_757244, BC-4-PP, AIDS124351, AIDS-124351, NSC23832, EINECS 275-305-7, 1-Benzyl-4-cyano-4-phenylpiperidine, NSC 23832, 1-Benzyl-4-phenyl-4-piperidinecarbonitrile, ST5307945, TL8006225, 1-N-Benzyl-4-cyano-4-phenylpiperidine hydrochloride, 4-Piperidinecarbonitrile, 4-phenyl-1-(phenylmethyl)-, 1-Benzyl-4-phenylpiperidine-4-carbonitrile monohydrochloride, 71258-18-9

Molecular Formula: C19H20N2Molecular Weight: 276.375500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: AUBONLVMDCVPQE-UHFFFAOYSA-N

• 1,2-Benzanthracene
IUPAC Name: benzo[a]anthracene | CAS Registry Number: 56-55-3
Synonyms: Benzanthracene, Benz[a]anthracene, Tetraphene, Naphthanthracene, Benzanthrene, Benzoanthracene, Benzo(a)anthracene, 1,2-Benzanthrene, 2,3-Benzphenanthrene, Benzo(b)phenanthrene, Benzo[a]anthracene, 1,2-Benzoanthracene, 1,2-Benzanthrazen, BENZ(A)ANTHRACENE, 2,3-Benzophenanthrene, Benzo[a]phenanthrene, Benzo[b]phenanthrene, Ambap123, 1,2-Benz(a)anthracene, RCRA waste no. U018

Molecular Formula: C18H12Molecular Weight: 228.287880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: DXBHBZVCASKNBY-UHFFFAOYSA-N

• (R)-Glycidol
IUPAC Name: [(2R)-oxiran-2-yl]methanol | CAS Registry Number: 57044-25-4
Synonyms: (R)-Oxiranemethanol, R(+)-glycidol, (+)-Glycidol, (R)-()-Glycidol, (R)-(+)-Glycidol, (2R)-oxiran-2-ylmethanol, (R)-()-Oxirane-2-methanol, (R)-3-hydroxy-1,2-epoxypropane, 480819_ALDRICH, CHEBI:18664, c0082, ZINC00900548, (R)-(+)-2,3-Epoxy-1-propanol, TL8003674, InChI=1/C3H6O2/c4-1-3-2-5-3/h3-4H,1-2H, 556-52-5, 60456-23-7

Molecular Formula: C3H6O2Molecular Weight: 74.078540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CTKINSOISVBQLD-GSVOUGTGSA-N

• (1-Ethoxycarbonylethylethylidene)Triphenylphosporane
IUPAC Name: ethyl 2-tri(phenyl)phosphoranylidenepropanoate | CAS Registry Number: 5717-37-3
Synonyms: 377708_ALDRICH, AIDS156119, AIDS-156119, NSC76468, EINECS 227-215-4, (Carbethoxyethylidine)triphenylphosphorane, Ethyl 2-(triphenylphosphoranylidene)propionate, NSC158468 (CHLORIDE SALT), (Carbethoxyethylidene)triphenylphosphorane, Ethyl 2-(triphenylphosphoranyl)propanoate, 18480-27-8 (CHLORIDE SALT), ST5406250, Ethyl 2-(triphenylphosphoranylidene)propanoate, 1-(Ethoxycarbonyl)ethylidenetriphenylphosphorane, Propanoic acid, 2-(triphenylphosphoranylidene)-, ethyl ester, Phosphonium, (1-carboxyethyl)triphenyl-, ethyl ester-, Phosphonium, (1-carboxyethyl)triphenyl-, chloride, ethyl ester, Propionic acid, 2-(triphenylphosphoranylidene)-, ethyl ester

Molecular Formula: C23H23O2PMolecular Weight: 362.401281 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: KZENFXVDPUMQOE-UHFFFAOYSA-N

• 1-N-Boc-Piperazine
IUPAC Name: tert-butyl piperazine-1-carboxylate | CAS Registry Number: 57260-71-6
Synonyms: 1-Boc-piperazine, 1-N-Boc-piperazine, t-Butyl 1-piperazincarboxylate, N-t-Butoxycarbonylpiperazine, t-Butyl 1-piperaziencarboxylate, 343536_ALDRICH, ARONIS005638, tert-butyl piperazine-1-carboxylate, 15502_FLUKA, ST5210645, TL8003687, 1-piperazinecarboxylic acid, 1,1-dimethylethyl ester, InChI=1/C9H18N2O2/c1-9(2,3)13-8(12)11-6-4-10-5-7-11/h10H,4-7H2,1-3H

Molecular Formula: C9H18N2O2Molecular Weight: 186.251420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CWXPZXBSDSIRCS-UHFFFAOYSA-N

• (1-Bromoethyl)benzene
IUPAC Name: 1-bromoethylbenzene | CAS Registry Number: 585-71-7
Synonyms: 1-Phenethyl bromide, 1-Phenylethyl bromide, Benzene, (1-bromoethyl)-, 1-Bromo-1-phenylethane, 1-Phenyl-1-bromoethane, alpha-Phenethyl bromide, alpha-Methylbenzyl bromide, 1-bromoethyl-benzene, alpha-Phenylethyl bromide, (1-BROMOETHYL)BENZENE, (alpha-Bromoethyl)benzene, .alpha.-Methylbenzyl bromide, .alpha.-Phenethyl bromide, .alpha.-Phenylethyl bromide, CCRIS 1779, (.alpha.-Bromoethyl)benzene, HSDB 2736, 238104_ALDRICH, NSC 8052, Benzene, (1-bromoethyl)-, (R)-

Molecular Formula: C8H9BrMolecular Weight: 185.061060 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: CRRUGYDDEMGVDY-UHFFFAOYSA-N

• 2-Bromoterephthalic acid
IUPAC Name: 2-bromoterephthalic acid | CAS Registry Number: 586-35-6
Synonyms: Bromoterephthalic acid, 115274_ALDRICH, NSC3985, EINECS 209-572-8, SBB012452, 2-Bromo-1,4-benzenedicarboxylic acid, InChI=1/C8H5BrO4/c9-6-3-4(7(10)11)1-2-5(6)8(12)13/h1-3H,(H,10,11)(H,12,13

Molecular Formula: C8H5BrO4Molecular Weight: 245.026900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: QPBGNSFASPVGTP-UHFFFAOYSA-N

• 1-Chloro-6-hydroxyhexane
IUPAC Name: 6-chlorohexan-1-ol | CAS Registry Number: 2009-83-8
Synonyms: 6-Chlorohexanol, 6-Chloro-1-hexanol, omega-Chlorohexanol, 1-Hexanol, 6-chloro-, 1-Chloro-6-hexanol, Hexamethylene chlorohydrin, 6-Chlorohexan-1-ol, 6-CHLOROHEXYL CYANIDE, C45008_ALDRICH, NSC 3700, EINECS 217-925-2, NSC3700, BRN 1697307, ZINC01666983, AI3-61541, LS-75384, 4-01-00-01704 (Beilstein Handbook Reference), InChI=1/C6H13ClO/c7-5-3-1-2-4-6-8/h8H,1-6H

Molecular Formula: C6H13ClOMolecular Weight: 136.619820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: JNTPTNNCGDAGEJ-UHFFFAOYSA-N

• 1-Bromo-2-naphthoic acid
IUPAC Name: 1-bromonaphthalene-2-carboxylic acid | CAS Registry Number: 20717-79-7
Synonyms: Maybridge4_002377, B7252_SIGMA, CID88665, EINECS 243-984-9, JFD 03900

Molecular Formula: C11H7BrO2Molecular Weight: 251.076080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VUVIRKAVBZITDO-UHFFFAOYSA-N

• (R)-Styrene oxide
IUPAC Name: (2R)-2-phenyloxirane | CAS Registry Number: 20780-53-4
Synonyms: R-Phenyloxirane, (R)-Phenyloxirane, (R)-(+)-Styrene oxide, R-STYRENE OXIDE, (R)-(Epoxyethyl)benzene, (2R)-2-phenyloxirane, (R)-()-Phenyloxirane, (R)-()-Styrene oxide, (R)-Phenylethylene oxide, Oxirane, phenyl-, (2R)-, CCRIS 4093, MLS001066357, Benzene, (epoxyethyl)-, (R)-, 540099_ALDRICH, 78880_FLUKA, CHEBI:45389, ZINC00901251, LS-30064, LS-30065, SMR000471848

Molecular Formula: C8H8OMolecular Weight: 120.148520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: AWMVMTVKBNGEAK-QMMMGPOBSA-N

• (1S)-(+)-Camphor-10-sulfonyl chloride
IUPAC Name: [(1S,4R)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonyl chloride | CAS Registry Number: 21286-54-4
Synonyms: Camphor-10-sulfonyl chloride, 219576_ALDRICH, 21380_FLUKA, ()-Camphor-10-sulfonyl chloride, EINECS 244-314-8, ()-Camphor-10-sulfonic acid chloride, d-2-Oxobornane-10-sulphonyl chloride, (1S)-()-10-Camphorsulfonyl chloride, (1S)-()-Camphor-10-sulfonyl chloride, (1S)-Camphor-10-sulfonic acid chloride

Molecular Formula: C10H15ClO3SMolecular Weight: 250.742300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BGABKEVTHIJBIW-GMSGAONNSA-N

• 1,2,3,4-1,2,3,4-Dibenzanthracene
IUPAC Name: benzo[b]triphenylene | CAS Registry Number: 215-58-7
Synonyms: Benzotriphenylene, Dibenzanthracene, Benzo[b]triphenylene, Benzo(b)triphenylene, Dibenz(a,c)anthracene, 2,3-Benzotriphenylene, Dibenzo(a,c)anthracene, Dibenzo[a,c]anthracene, Ambap124, Dibenz[a,c]anthracene, DIBENZANTHRACENES, 1,2:3,4-Dibenzanthracene, 1,2:3,4-Dibenzoanthracene, CCRIS 934, BCR094_FLUKA, D31206_ALDRICH, 1,2,3,4-DIBENZANTHRACENE, EINECS 205-920-8, BRN 1912415, LS-41573

Molecular Formula: C22H14Molecular Weight: 278.346560 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: RAASUWZPTOJQAY-UHFFFAOYSA-N

• 1-Methylguanidine Hydrochloride
IUPAC Name: carbamimidoyl(methyl)azanium chloride | CAS Registry Number: 21770-81-0
Synonyms: 1-Methylguanidine hydrochloride, N-Methylguanidine hydrochloride, Methylguanidine monohydrochloride, GUANIDINE, 1-METHYL-, HYDROCHLORIDE, LS-73791, Guanidine, methyl-, monohydrochloride (8CI,9CI)

Molecular Formula: C2H8ClN3Molecular Weight: 109.558020 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: VJQCNCOGZPSOQZ-UHFFFAOYSA-N


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