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Ubichem plc

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Contact: Toni Wilton - Fine Chemical Sales
Web: http://www.ubichem.com
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Address: Mayflower Close, Chandlers Ford Industrial Estate, Eastleigh, Hampshire SO53 4AR, United Kingdom
Phone: +44-(23)-80263030 | Fax: +44-(23)-80263012 | Map/Directions >>

Profile: Ubichem Plc specializes in supplying fine chemicals for pharmaceutical industries. Our products include 4-chlorothieno(3,2-c)pyridine, 4-bromothieno(3,2-c)pyridine, 4-(1-piperazinyl)thieno(3,2-c)pyridine, 7-bromo-4-hydrazinothieno(3,2-c)pyridine and 1-amino-4-bromo isoquinoline. We also offer heterocyclic boronic acids, chelates, phenyl boronic acids, borate esters and amino acids.

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• 2,5-Difluorobenzylamine
IUPAC Name: (2,5-difluorophenyl)methanamine | CAS Registry Number: 85118-06-5
Synonyms: 264385_ALDRICH, Benzenemethanamine, 2,5-difluoro-, 1-(2,5-difluorophenyl)methanamine, ALBB-005359, JRD-0444, EINECS 285-658-9, SBB006678

Molecular Formula: C7H7F2NMolecular Weight: 143.133986 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: GDFBHCMFIUBEQT-UHFFFAOYSA-N

• 2-Aminopyridine-5-boronic acid, pinacol ester
IUPAC Name: 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-amine | CAS Registry Number: 827614-64-2
Synonyms: 640379_ALDRICH, BM246, 2-Aminopyridine-5-boronic acid pinacol ester, 6-Aminopyridine-3-boronic acid pinacol ester, 2-Amino-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

Molecular Formula: C11H17BN2O2Molecular Weight: 220.075880 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YFTAUNOLAHRUIE-UHFFFAOYSA-N

• 4,4-(dimethylcyclohexene-1-yl)boronic acid, pinacol ester
IUPAC Name: 2-(4,4-dimethylcyclohexen-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane | CAS Registry Number: 859217-67-7
Synonyms: 4,4-(Dimethylcyclohexen-1-yl)boronic acid pinacol ester, 4,4-(DIMETHYLCYCLOHEXENE-1-YL)BORONIC ACID, PINACOL ESTER, 2-(4,4-dimethylcyclohexen-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 2-(4,4-Dimethyl-1-cyclohexen-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, 2-(4,4-dimethylcyclohex-1-en-1-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane, SureCN1701389, CTK8B3059, MolPort-002-054-880, ANW-41717, AKOS015960158, MB06490, AK-38121, EN001045, KB-10193, FT-0686436, B-4634, A841496, 4,4-dimethylcyclohex-1-enylboronic acid pinacol ester, 4,4-Dimethylcyclohexen-1-ylboronic acid, pinacol ester, 4,4-Dimethylcyclohexen-1-ylboronic acid, pinacol ester,

Molecular Formula: C14H25BO2Molecular Weight: 236.158100 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JQEUELMRQYUNDS-UHFFFAOYSA-N

• 1,4-phenyldiboronic acid, bis(pinacol) ester
IUPAC Name: 4,4,5,5-tetramethyl-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,2-dioxaborolane | CAS Registry Number: 99770-93-1
Synonyms: 1,4-Benzenediboronic acid bis(pinacol) ester, 1,4-Bis(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzene, SureCN228212, AMTB185, 663816_ALDRICH, MolPort-002-055-037, MAY00077, AKOS015960165, 1,4-Benzenediboronic acid dipinacol ester, 1,4-Phenylenediboronic acid pinacol ester, KB-10634, 1,4-Phenylenediboronic acid, pinacol ester,, Benzene-1,4-diboronic acid, pinacol diester, 10.14272/UOJCDDLTVQJPGH-UHFFFAOYSA-N, B-1310, doi:10.14272/UOJCDDLTVQJPGH-UHFFFAOYSA-N, 1,4-PHENYLDIBORONIC ACID, BIS(PINACOL) ESTER, 4,4,5,5-tetramethyl-2-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1,3,2-dioxaborolane

Molecular Formula: C18H28B2O4Molecular Weight: 330.034520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: UOJCDDLTVQJPGH-UHFFFAOYSA-N

• 2,6-Difluorobenzoyl chloride
IUPAC Name: 2,6-difluorobenzoyl chloride | CAS Registry Number: 18063-02-0
Synonyms: 249408_ALDRICH, Benzoyl chloride, 2,6-difluoro-, ZINC02140810, CID87438, JRD-0238, EINECS 241-971-2, SBB006739, TL8001441

Molecular Formula: C7H3ClF2OMolecular Weight: 176.547926 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QRHUZEVERIHEPT-UHFFFAOYSA-N

• 2,2'-Dihydroxy-4-methoxybenzophenone
IUPAC Name: (2-hydroxy-4-methoxyphenyl)-(2-hydroxyphenyl)methanone | CAS Registry Number: 131-53-3
Synonyms: dioxybenzone, Dioxybenzon, Dioxibenzonum, Solaquin, Advastab 47, Benzophenone-8, Cyasorb UV 24, Spectra-sorb UV 24, Mixture Name, Cyasorb UV 24 Light Absorber, Spectrum_000978, UF 2, Dioxybenzone [USAN:INN], Dioxybenzonum [INN-Latin], Dioxibenzona [INN-Spanish], Prestwick0_000898, Prestwick1_000898, Prestwick2_000898, Prestwick3_000898, Spectrum2_001032

Molecular Formula: C14H12O4Molecular Weight: 244.242680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: MEZZCSHVIGVWFI-UHFFFAOYSA-N

• 2-Cyanomethylbromobenzene
IUPAC Name: 2-(2-bromophenyl)acetonitrile | CAS Registry Number: 19472-74-3
Synonyms: 2-Bromobenzyl cyanide, 2-Bromophenylacetonitrile, o-Bromobenzyl cyanide, (2-Bromophenyl)acetonitrile, Benzeneacetonitrile, 2-bromo-, 259969_ALDRICH, CID29625, EINECS 243-091-4, NSC338412, ZINC00157212, BBV-035932, NSC 338412, S01-0198, InChI=1/C8H6BrN/c9-8-4-2-1-3-7(8)5-6-10/h1-4H,5H

Molecular Formula: C8H6BrNMolecular Weight: 196.043940 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BVCOJESIQPNOIF-UHFFFAOYSA-N

• 2,4,5-Trifluoronitrobenzene
IUPAC Name: 1,2,4-trifluoro-5-nitrobenzene | CAS Registry Number: 2105-61-5
Synonyms: Ambap4493, 1,2,4-Trifluoro-5-nitrobenzene, 258970_ALDRICH, 5-Nitro-1,2,4-trifluorobenzene, Benzene, 1,2,4-trifluoro-5-nitro-, NSC10248, EINECS 218-281-5, ZINC01706149, TL8001743

Molecular Formula: C6H2F3NO2Molecular Weight: 177.080790 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: ROJNMGYMBLNTPK-UHFFFAOYSA-N

• 2-Bromo Benzyl Amine HCl
IUPAC Name: (2-bromophenyl)methanamine chloride | CAS Registry Number: 5465-63-4
Synonyms: NSC29035

Molecular Formula: C7H8BrClN-Molecular Weight: 221.502120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MDEJOHXOXKDGOU-UHFFFAOYSA-M

• 2,3,4-Trimethoxy Cinnamic Acid
IUPAC Name: (E)-3-(2,3,4-trimethoxyphenyl)prop-2-enoate | CAS Registry Number: 33130-03-9
Synonyms: ZINC00153644, CID5549419

Molecular Formula: C12H13O5-Molecular Weight: 237.228620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: ZYOPDNLIHHFGEC-FNORWQNLSA-M

• 2,4-Difluoro Benzonitrile
IUPAC Name: 2,4-difluorobenzonitrile | CAS Registry Number: 3939-09-1
Synonyms: 2,4-Difluorobenzonitrile, Benzonitrile, 2,4-difluoro-, 264326_ALDRICH, ZINC00159425, BB_SC-3006, CID77545, JRD-0080, EINECS 223-523-8, 3S210990

Molecular Formula: C7H3F2NMolecular Weight: 139.102226 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LJFDXXUKKMEQKE-UHFFFAOYSA-N

• 2,4,5-Trifluoro Aniline
IUPAC Name: 2,4,5-trifluoroaniline | CAS Registry Number: 367-34-0
Synonyms: 2,4,5-Trifluoroaniline, Ambap3047, Benzenamine, 2,4,5-trifluoro-, 311081_ALDRICH, NSC10289, CID94953, JRD-0262, EINECS 206-692-2, ZINC00409371, AI3-52252, TL8002714

Molecular Formula: C6H4F3NMolecular Weight: 147.097870 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QMYVWJVVVMIBMM-UHFFFAOYSA-N

• 2,5-Dimethoxy Cinnamic Acid
IUPAC Name: (E)-3-(2,5-dimethoxyphenyl)prop-2-enoic acid | CAS Registry Number: 10538-51-9
Synonyms: 2,5-Dimethoxycinnamic acid, 2',5'-Dimethoxycinnamic acid, 143596_ALDRICH, MEGxp0_001746, ACon1_002358, trans-2,5-Dimethoxycinnamic acid, ALBB-007461, EINECS 234-114-9, SBB000471, NCGC00169921-01, (2E)-3-(2,5-dimethoxyphenyl)acrylic acid, 2-Propenoic acid, 3-(2,5-dimethoxyphenyl)-, 2,5-Dimethoxycinnamic acid, predominantly trans, (2E)-3-(2,5-Dimethoxyphenyl)-2-propenoic acid, 38489-74-6, InChI=1/C11H12O4/c1-14-9-4-5-10(15-2)8(7-9)3-6-11(12)13/h3-7H,1-2H3,(H,12,13)/b6-3

Molecular Formula: C11H12O4Molecular Weight: 208.210580 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: JPQWWJZORKTMIZ-ZZXKWVIFSA-N

• 2-Bromopyridine-5-boronic Acid
IUPAC Name: (6-bromopyridin-3-yl)boronic acid | CAS Registry Number: 223463-14-7
Synonyms: 2-Bromopyridine-5-boronic acid, 2-Bromo-5-pyridineboronic Acid, 6-BROMOPYRIDINE-3-BORONIC ACID, 6-Bromopyridin-3-ylboronic acid, (6-bromopyridin-3-yl)boronic Acid, 2-Bromopyridine-5-boronicacid, 2-Bromo-5-pyridylboronic acid, 2-Bromopyridyl-5-boronic acid, 6-Bromo-3-pyridylboronic Acid, 6-bromopyridin-3-lboronic acid, SBB052564, 6-BROMOPYRIDIN-3-YL-3-BORONIC ACID, PubChem5082, ACMC-209fv5, KSC201Q2J, 666556_ALDRICH, AC1MC785, CTK1A1824, 5-BORONO-2-BROMOPYRIDINE, MolPort-000-139-312

Molecular Formula: C5H5BBrNO2Molecular Weight: 201.813700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: BCYWDUVHAPHGIP-UHFFFAOYSA-N

• 2-Chloro-4-carboxyphenylboronic Acid
IUPAC Name: 4-borono-3-chlorobenzoic acid | CAS Registry Number: 851335-09-6
Synonyms: 4-CARBOXY-2-CHLOROPHENYLBORONIC ACID, 4-borono-3-chlorobenzoic acid, 2-Chloro-4-carboxyphenylboronic acid, SBB065902, 4-Carboxy-2-chlorobenzeneboronic acid, AG-H-41923, 3-chloro-4-(dihydroxyboranyl)benzoic acid, BENZOIC ACID, 4-BORONO-3-CHLORO-, ACMC-209q4s, SureCN393695, AGN-PC-01LR0Q, KSC497Q8L, CTK3J7885, MolPort-001-769-284, BM619, ACT11079, ANW-38138, 4-Carboxy-2-chlorophenylboronic acid,, AKOS015836312, AB30715

Molecular Formula: C7H6BClO4Molecular Weight: 200.384140 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 4

InChIKey: FYDHSNLXZRGWFU-UHFFFAOYSA-N

• 2-Bromo-3-fluorobenzoic acid
IUPAC Name: 2-bromo-3-fluorobenzoic acid | CAS Registry Number: 132715-69-6
Synonyms: 3-fluoro-2-bromobenzoic acid, 2-Bromo-3-fluorobenzoicacid, SBB062989, NSC190303, PubChem1319, ACMC-1C0RE, SureCN394187, KSC174C5P, 2-bromo-3-fluoro-benzoic acid, AC1L70X1, Jsp001983, Benzoicacid, 2-bromo-3-fluoro-, CTK0H4157, BUTTPARK 22\01-97, MolPort-000-152-029, WT005, ACN-S004089, ACT00343, ANW-19457, AKOS005063818

Molecular Formula: C7H4BrFO2Molecular Weight: 219.007863 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KQRCBMPPEPNNDS-UHFFFAOYSA-N

• 2-amino-4-fluorobenzoic acid
IUPAC Name: 2-amino-4-fluorobenzoic acid | CAS Registry Number: 446-32-2
Synonyms: 4-Fluoroanthranilic acid, 2-Amino-4-fluorobenzoic acid, 370169_ALDRICH, 07972_FLUKA, EINECS 207-163-9, SBB006590, A197, TL8003119, A-5520, 3S104455, InChI=1/C7H6FNO2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,9H2,(H,10,11

Molecular Formula: C7H6FNO2Molecular Weight: 155.126443 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: LGPVTNAJFDUWLF-UHFFFAOYSA-N

• 2-amino-6-fluorobenzoic acid
IUPAC Name: 2-amino-6-fluorobenzoate | CAS Registry Number: 434-76-4
Synonyms: ZINC00153055, CID6930714

Molecular Formula: C7H5FNO2-Molecular Weight: 154.118503 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: RWSFZKWMVWPDGZ-UHFFFAOYSA-M

• 5-Benzyloxyindole
IUPAC Name: 5-(phenylmethoxy)-1H-indole | CAS Registry Number: 1215-59-4
Synonyms: 5-(Benzyloxy)indole, Benzyloxy-5 indole, 5-Benzyloxy-1H-indole, 1H-Indole, 5-(phenylmethoxy)-, Maybridge3_006788, Indole, 5-(benzyloxy)-, Benzyloxy-5 indole [French], INDOLE, 5-BENZYLOXY-, Oprea1_825327, B27803_ALDRICH, WLN: T56 BMJ GO1R, EINECS 214-930-1, NSC 62895, NSC62895, BRN 0173532, SBB003331, ZINC00129178, B2318G1, IDI1_018175, 1H-Indole, 5-(phenylmethoxy)- (9CI)

Molecular Formula: C15H13NOMolecular Weight: 223.269820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JCQLPDZCNSVBMS-UHFFFAOYSA-N

• (1S,2R)-(-)-1Amino-2-indanol
IUPAC Name: [(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]azanium | CAS Registry Number: 126456-43-7
Synonyms: ZINC00154811, ZINC00154815, CID10942615

Molecular Formula: C9H12NO+Molecular Weight: 150.197680 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: LOPKSXMQWBYUOI-BDAKNGLRSA-O

• 2-Amino-3-bromo-5-methylbenzoic acid
IUPAC Name: 2-amino-3-bromo-5-methylbenzoic acid | CAS Registry Number: 13091-43-5
Synonyms: 631531_ALDRICH, SBB005907, FS000849

Molecular Formula: C8H8BrNO2Molecular Weight: 230.058620 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: LCMZECCEEOQWLQ-UHFFFAOYSA-N

• 2-Amino-6-bromopyridine
IUPAC Name: 5-bromoimidazo[1,2-a]pyridine | CAS Registry Number: 19798-81-3
Synonyms: 5-Bromo-imidazo[1,2-a]pyridine, FS002047

Molecular Formula: C7H5BrN2Molecular Weight: 197.032000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CCOFGVWHMYYDBG-UHFFFAOYSA-N

• 2,5-Difluoromandelic acid
IUPAC Name: 2-(2,5-difluorophenyl)-2-hydroxyacetic acid | CAS Registry Number: 207853-61-0
Synonyms: 2,5-difluoro mandelic acid, 2-(2,5-difluorophenyl)-2-hydroxyacetic acid, (2,5-Difluorophenyl)(hydroxy)acetic acid, AC1LBTCD, SureCN1668569, MolPort-000-154-368, SBB063936, AKOS009158212, MCULE-2533360656, AC-10453, KB-105312, FT-0610361, FT-0652897, ST50408068, A814894, I01-3404, I01-6693, 2-[2,5-bis(fluoranyl)phenyl]-2-oxidanyl-ethanoic acid

Molecular Formula: C8H6F2O3Molecular Weight: 188.128246 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: PATKDMCCMCSATF-UHFFFAOYSA-N

• 1-(3-Dimethylaminopropyl)-3-ethylcarbodiimide methiodide
IUPAC Name: 3-(ethyliminomethylideneamino)propyl-trimethylazanium iodide | CAS Registry Number: 22572-40-3
Synonyms: EDC methiodide, 165344_ALDRICH, EINECS 245-095-1, NSC282762, NSC 282762, 1-[3-(Dimethylamino)propyl]-3-ethylcarbodiimide methiodide, 1-ethyl-3-(3-(dimethylamino)propyl)carbodiimide methiodide, (3-((Ethylimidocarbonyl)amino)propyl)trimethylammonium iodide, 1-Propanaminium, 3-(ethylcarbonimidoylamino)-N,N,N-trimethyl-, iodide

Molecular Formula: C9H20IN3Molecular Weight: 297.179670 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AGSKWMRPXWHSPF-UHFFFAOYSA-M

• 2-Amino-3-cyanopyridine
IUPAC Name: 2-aminopyridin-1-ium-3-carbonitrile | CAS Registry Number: 24517-64-4
Synonyms: ZINC00332991, CID6946533

Molecular Formula: C6H6N3+Molecular Weight: 120.131940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: YYXDQRRDNPRJFL-UHFFFAOYSA-O

• 3-Bromo-1,1,1-trifluoroacetone
IUPAC Name: 3-bromo-1,1,1-trifluoropropan-2-one | CAS Registry Number: 431-35-6
Synonyms: Bromotrifluoroacetone, 1-Bromo-3,3,3-trifluoroacetone, 374059_ALDRICH, 3-Bromo-1,1,1-trifluoropropanone, 18545_FLUKA, CID79008, EINECS 207-071-9, SBB006605, ZINC02579119, 3-Bromo-1,1,1-trifluoro-2-propanone, TL8003040, InChI=1/C3H2BrF3O/c4-1-2(8)3(5,6)7/h1H

Molecular Formula: C3H2BrF3OMolecular Weight: 190.946590 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: ONZQYZKCUHFORE-UHFFFAOYSA-N

• 2,6-Difluorotoluene
IUPAC Name: 1,3-difluoro-2-methylbenzene | CAS Registry Number: 443-84-5
Synonyms: Ambap4947, 1,3-Difluoro-2-methylbenzene, 347299_ALDRICH, CID581493, D197, TL8003092

Molecular Formula: C7H6F2Molecular Weight: 128.119346 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MZLSNIREOQCDED-UHFFFAOYSA-N

• 2,6-Dichlorocinnamic acid
IUPAC Name: (E)-3-(2,6-dichlorophenyl)prop-2-enoic acid | CAS Registry Number: 5345-89-1
Synonyms: NSC 1762, EINECS 226-301-9, NSC1762, 2-Propenoic acid, 3-(2,6-dichlorophenyl)-, 3-(2,6-Dichlorophenyl)-2-propenoic acid, Cinnamic acid, 2,6-dichloro- (6CI,7CI), ST074429, LS-123618, 3-(2,6-DICHLOROPHENYL)PROPENOIC ACID, InChI=1/C9H6Cl2O2/c10-7-2-1-3-8(11)6(7)4-5-9(12)13/h1-5H,(H,12,13)/b5-4

Molecular Formula: C9H6Cl2O2Molecular Weight: 217.048740 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OIPVGRCXMFBNAN-SNAWJCMRSA-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

• 2,6-Difluorophenylacetonitrile
IUPAC Name: 2-(2,6-difluorophenyl)acetonitrile | CAS Registry Number: 654-01-3
Synonyms: 264512_ALDRICH, (2,6-Difluorophenyl)acetonitrile, Benzeneacetonitrile, 2,6-difluoro-, JRD-0487, EINECS 211-504-7, SBB006682, ZINC00409205

Molecular Formula: C8H5F2NMolecular Weight: 153.128806 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: GVAYBGQTAADLJS-UHFFFAOYSA-N

• 2,4-Difluorophenylacetonitrile
IUPAC Name: 2-(2,4-difluorophenyl)acetonitrile | CAS Registry Number: 656-35-9
Synonyms: 264490_ALDRICH, (2,4-Difluorophenyl)acetonitrile, ZINC00155244, Benzeneacetonitrile, 2,4-difluoro-, CID69565, JRD-0301, (2,4-Difluoro-phenyl)-acetonitrile, EINECS 211-514-1, HAN 00045

Molecular Formula: C8H5F2NMolecular Weight: 153.128806 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AGAOESUOSOGZOD-UHFFFAOYSA-N

• 2,4-Difluorophenylacetic acid
IUPAC Name: 2-(2,4-difluorophenyl)acetic acid | CAS Registry Number: 81228-09-3
Synonyms: 264474_ALDRICH, Benzeneacetic acid, 2,4-difluoro-, 36948_FLUKA, JRD-0102, (2,4-Difluoro-phenyl)-acetic acid, EINECS 279-709-4, ST5405115

Molecular Formula: C8H6F2O2Molecular Weight: 172.128846 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: QPKZIGHNRLZBCL-UHFFFAOYSA-N

• 2,3,5-Triiodobenzoic acid
IUPAC Name: 2,3,5-triiodobenzoic acid | CAS Registry Number: 88-82-4
Synonyms: Floraltone, Johnkolor, Triiodobenzoic acid, TIBA, Regim 8, Regin 8, Caswell No. 890A, 2,3,5-TRIIODOBENZOIC ACID, Benzoic acid, 2,3,5-triiodo-, Triiodobenzoic acid (VAN), WLN: QVR BI CI EI, 2,3,5-TIBA, T5910_SIGMA, 120979_ALDRICH, NSC 2582, EINECS 201-859-6, CID6948, NSC2582, AIDS018028, EPA Pesticide Chemical Code 009104

Molecular Formula: C7H3I3O2Molecular Weight: 499.810930 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ZMZGFLUUZLELNE-UHFFFAOYSA-N

• 2,4-Dihydroxy-3-nitropyridine
IUPAC Name: 4-hydroxy-3-nitro-1H-pyridin-2-one | CAS Registry Number: 89282-12-2
Synonyms: 3-Nitropyridine-2,4-diol, 3-nitro-2,4-pyridinediol, 4,6-Dihydroxy-5-nitropyridine, 4-Hydroxy-3-nitro-2-pyridone, AE-842/32231011, PubChem5469, ACMC-209qzb, SureCN1191637, KSC495S9N, CTK3J5996, MolPort-000-139-945, ACN-S001261, ANW-39237, CL0010, SBB055676, ZINC12360011, 2-hydroxy-3-nitro-1H-pyridin-4-one, 4-Hydroxy-3-nitro-2(1H)-pyridinone, AKOS005257339, 3-nitro-2-oxidanyl-1H-pyridin-4-one

Molecular Formula: C5H4N2O4Molecular Weight: 156.096260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: BKYGVGWYPFVKTK-UHFFFAOYSA-N

• 1,5-Pentanedithiol
IUPAC Name: pentane-1,5-dithiol | CAS Registry Number: 928-98-3
Synonyms: 1,5-Dimercaptopentane, Pentane-1,5-dithiol, Pentamethylene dimercaptan, 242551_ALDRICH, 76920_FLUKA, NSC51699, EINECS 213-194-9, ZINC03861696

Molecular Formula: C5H12S2Molecular Weight: 136.278780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: KMTUBAIXCBHPIZ-UHFFFAOYSA-N

• 2-(Trifluoromethoxy)benzaldehyde
IUPAC Name: 2-(trifluoromethoxy)benzaldehyde | CAS Registry Number: 94651-33-9
Synonyms: 529168_ALDRICH, ZINC02168641, BB_SC-4435, JRD-0647, CID2777192, 2-(TRIFLUOROMETHOXY)-BENZALDEHYDE, TL8005968

Molecular Formula: C8H5F3O2Molecular Weight: 190.119310 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: CPHXLFKIUVVIOQ-UHFFFAOYSA-N

• 2-Chloro-3-methylpyrazine
IUPAC Name: 2-chloro-3-methylpyrazine | CAS Registry Number: 95-58-9
Synonyms: 2-Methyl-3-chloropyrazine, Pyrazine, 2-chloro-3-methyl-, NSC41093, CID66769, EINECS 202-434-8, NSC 41093, TL8005989, UX00005201

Molecular Formula: C5H5ClN2Molecular Weight: 128.559600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WZHWPZQQPWKEAV-UHFFFAOYSA-N

• 6-Benzyloxypyridine-3-boronic acid
IUPAC Name: (6-phenylmethoxypyridin-3-yl)boronic acid | CAS Registry Number: 929250-35-1
Synonyms: 6-(BENZYLOXY)PYRIDINE-3-BORONIC ACID, 2-Benzyloxypyridine-5-boronic acid, 6-(benzyloxy)pyridin-3-ylboronic acid, AG-H-80324, ACMC-209rj6, AGN-PC-01LR0F, SureCN1696142, AMTB318, CTK5H1897, MolPort-001-761-061, BM433, 6-Benzyloxypyridine-3-boronic acid,, ANW-39952, OR2584, 2-(Benzyloxy)pyridine-5-boronic acid, AKOS015839397, AB29893, RL05851, (6-(Benzyloxy)pyridin-3-yl)boronic acid, AK-45636

Molecular Formula: C12H12BNO3Molecular Weight: 229.039580 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: CUZOGAUUSKBDAO-UHFFFAOYSA-N

• (1R,2R)-1,2-Di(4'-methoxyphenyl)-1,2-diaminoethane
IUPAC Name: (1S,2S)-1,2-bis(4-methoxyphenyl)ethane-1,2-diamine | CAS Registry Number: 58520-04-0
Synonyms: (1S,2S)-1,2-DI(4'-METHOXYPHENYL)-1,2-DIAMINOETHANE, 1S,2S-1,2-Di(4'-methoxyphenyl)-1,2-diaminoethan, 58520-03-9, PubChem12629, AC1LELP9, (1S,2S)-1,2-bis(4-methoxyphenyl)ethane-1,2-diamine, SureCN1900910, MolPort-003-987-739, AKOS015915303, AC-19122, AK-35751, Q949, KB-205395, TL8006571, FT-0653710, TL80090963, I14-5915, (1R,2R)-1,2-Di(4'-methoxyphenyl)-1,2-diaminoethane, (1S,2S)-1,2-Di(4'-methoxyphenyl)-1,2-diaminoethane

Molecular Formula: C16H20N2O2Molecular Weight: 272.342200 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: ZWMPRHYHRAUVGY-HOTGVXAUSA-N

• 2-Amino-5-methylphenyboronic acid, pinacol ester
IUPAC Name: 4-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline | CAS Registry Number: 948592-80-1
Synonyms: 2-AMINO-5-METHYLPHENYBORONIC ACID, PINACOL ESTER, 4-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline, 2-Amino-5-methylphenyboronic acid pinacol ester, 2-Amino-5-methylbenzeneboronic acid, pinacol ester, SureCN3191098, AGN-PC-01LR07, BESTIPHARMA 525-084, CTK8B3178, BM323, ANW-41908, AKOS015893487, AB29207, OR40461, KB-20128, AB1007756, A-3736, A845116, I04-5901, 4-methyl-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)aniline, 4-METHYL-2-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-BENZENAMINE

Molecular Formula: C13H20BNO2Molecular Weight: 233.114400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LOOBNTHIWCHTCR-UHFFFAOYSA-N

• 2-(4-tert-Butoxycarbonylpiperazin-1-yl)pyridine-4-boronic acid, pinacol ester
IUPAC Name: tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine-1-carboxylate | CAS Registry Number: 936250-21-4
Synonyms: 2-(4-BOC-piperazino)pyridine-4-boronic acid, pinacol ester, 2-(4-TERT-BUTOXYCARBONYLPIPERAZIN-1-YL)PYRIDINE-4-BORONIC ACID, PINACOL ESTER, 2-[4-(tert-Butoxycarbonyl)piperazin-1-yl]-4-(4,4,5,5-tetramethyl,1,3,2-dioxaborolan-2-yl)pyridine, tert-Butyl 4-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl)piperazine-1-carboxylate, tert-butyl 4-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]piperazine-1-carboxylate, AGN-PC-01NOTS, SureCN1073012, CTK7G3382, MolPort-002-054-907, MAY00032, ANW-43339, AKOS015950032, AB29765, AG-A-70383, AK115460, KB-14678, A-3854, 2-(4-BOC-piperazino)pyridine-4-boronic acid pinacol ester, 2-(4-BOC-PIPERAZIN-1-YL)PYRIDINE-4-BORONIC ACID PINACOL ESTER, 2-(4-N-BOC-PIPERAZIN-1-YL)PYRIDINE-4-BORONIC ACID, PINACOL ESTER

Molecular Formula: C20H32BN3O4Molecular Weight: 389.296780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: NQBNJXYYAKBREJ-UHFFFAOYSA-N

• 2,4-Difluorophenylboronic acid, pinacol ester
IUPAC Name: 2-(2,4-difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane | CAS Registry Number: 288101-48-4
Synonyms: 632694_ALDRICH, BM142, 2,4-Difluorophenylboronic acid pinacol ester, 2-(2,4-Difluorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Molecular Formula: C12H15BF2O2Molecular Weight: 240.054106 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: HVKAOYLQBVBZDU-UHFFFAOYSA-N

• 2,6-Di-tert-butyl-4-methoxyphenol
IUPAC Name: 2,6-ditert-butyl-4-methoxyphenol | CAS Registry Number: 489-01-0
Synonyms: Topanol 354, 3,5-Di-tert-butyl-4-hydroxyanisole, CCRIS 5219, 2,6-DI-TERT-BUTYL-4-METHOXYPHENOL, 251062_ALDRICH, 3,5-di-t-Butyl-4-hydroxyanisole, 34713_FLUKA, EINECS 207-693-0, NSC 14451, NSC14451, Phenol, 2,6-di-tert-butyl-4-methoxy-, ZINC00056595, 2,6-Bis(1,1-dimethylethyl)-4-methoxyphenol, Phenol, 2,6-bis(1,1-dimethylethyl)-4-methoxy-, LS-104066, ST5306893, Phenol, 2,6-di-tert-butyl-4-methoxy- (8CI), 1,3-DITERT.BUTYL,2-HYDROXY,5-METHOXY-BENZENE, InChI=1/C15H24O2/c1-14(2,3)11-8-10(17-7)9-12(13(11)16)15(4,5)6/h8-9,16H,1-7H

Molecular Formula: C15H24O2Molecular Weight: 236.349860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: SLUKQUGVTITNSY-UHFFFAOYSA-N

• 1,8-Dinitronaphthalene
IUPAC Name: 1,8-dinitronaphthalene | CAS Registry Number: 602-38-0
Synonyms: 1,8-DINITRONAPHTHALENE, Naphthalene, 1,8-dinitro-, CCRIS 2840, NSC 6323, CHEBI:50642, EINECS 210-016-1, NSC6323, BRN 1881846, ZINC01693402, AI3-08844, LS-1434, 4-05-00-01681 (Beilstein Handbook Reference), InChI=1/C10H6N2O4/c13-11(14)8-5-1-3-7-4-2-6-9(10(7)8)12(15)16/h1-6

Molecular Formula: C10H6N2O4Molecular Weight: 218.165640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: AVCSMMMOCOTIHF-UHFFFAOYSA-N

• 2,4-dichloropyrido[2,3-d]pyrimidine
IUPAC Name: 2,4-dichloropyrido[2,3-d]pyrimidine | CAS Registry Number: 126728-20-9
Synonyms: 2,4-Dichloropyrido[2,3-d]pyrimidine, AG-D-56001, Pyrido[2,3-d]pyrimidine,2,4-dichloro-, ACMC-20aifk, CTK4B5322, MolPort-002-500-745, ACN-C001009, 2,4-dichloropyrido[2,3d]pyrimidine, ANW-74814, WTI-11631, ZINC15443477, AKOS006341331, PB22043, QC-3586, RP04227, 2,4-dichloro-pyrido[2,3-d]pyrimidine, AK-26765, KB-17474, AB1011592, 2,4-bis(chloranyl)pyrido[2,3-d]pyrimidine

Molecular Formula: C7H3Cl2N3Molecular Weight: 200.024820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QSNSZGYDLUPWSV-UHFFFAOYSA-N

• 2,8-Dimethyl-4-Hydrazinoquinoline
IUPAC Name: (2,8-dimethylquinolin-4-yl)hydrazine | CAS Registry Number: 49612-06-8
Synonyms: Quinolinyl-4-hydrazine der., 8-Methyl-4-hydrazinoquinaldine, AIDS072687, 2,8-Dimethyl-4-quinolylhydrazine, QU108, AIDS-072687, CID472389, ZINC02564396, BBV-00038403

Molecular Formula: C11H13N3Molecular Weight: 187.241020 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: XDMSDOXCZHKTDD-UHFFFAOYSA-N

• 1,3-Diphenoxybenzene
IUPAC Name: 1,3-diphenoxybenzene | CAS Registry Number: 3379-38-2
Synonyms: m-Diphenoxybenzene, Benzene, 1,3-diphenoxy-, m-Diphenyloxybenzene, m-Phenoxyphenoxybenzene, Benzene, m-diphenoxy-, Resorcinol diphenyl ether, JTNRGGLCSLZOOQ-UHFFFAOYSA-N, 1,1'-[1,3-phenylenebis(oxy)]dibenzene, F0348-3117, m-Diphenoxybenzol, EINECS 222-181-7, ACMC-1ADXK, 1,3-Diphenoxybenzene #, ChemDiv3_000025, AC1L2RY0, AC1Q57JG, m-3F2E, Oprea1_267541, SCHEMBL22559, 1,3-Benzenediol Diphenyl Ether

Molecular Formula: C18H14O2Molecular Weight: 262.308 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: JTNRGGLCSLZOOQ-UHFFFAOYSA-N

• 2-Bromromethylphenylboronic Acid
IUPAC Name: [2-(bromomethyl)phenyl]boronic acid | CAS Registry Number: 91983-14-1
Synonyms: 2-(Bromomethyl)phenylboronic acid, 2-Bromomethylphenylboronic acid, 679453_ALDRICH, BM444

Molecular Formula: C7H8BBrO2Molecular Weight: 214.852220 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: MYVJCOQGXCONPE-UHFFFAOYSA-N

• 2-Chloropyridine-4-boronic Acid
IUPAC Name: (2-chloropyridin-4-yl)boronic acid | CAS Registry Number: 458532-96-2
Synonyms: 2-Chloropyridine-4-boronic acid, 666513_ALDRICH, FS000014

Molecular Formula: C5H5BClNO2Molecular Weight: 157.362700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WJYRVVDXJMJLTN-UHFFFAOYSA-N

• 2,3-difluorobenzaldehyde
IUPAC Name: 2,3-difluorobenzaldehyde | CAS Registry Number: 2646-91-5
Synonyms: 2,3-Difluorobenzaldehyde, 265144_ALDRICH, ZINC02539336, JRD-0425, CID137664, SBB006572, TL8002115

Molecular Formula: C7H4F2OMolecular Weight: 142.102866 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: WDBAXYQUOZDFOJ-UHFFFAOYSA-N


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