Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.

4,126 – 4,140 of 73,813 results

4,126

2-chloro-5-(trifluoromethyl)benzene-1-sulfonyl chloride, 97%, Thermo Scientific™

CAS: 54090-08-3 Molecular Formula: C7H3Cl2F3O2S Molecular Weight (g/mol): 279.054 MDL Number: MFCD00052310 InChI Key: ZEYKLMDPUOVUCR-UHFFFAOYSA-N Synonym: 2-chloro-5-trifluoromethyl benzenesulfonyl chloride,2-chloro-5-trifluoromethyl benzene-1-sulfonyl chloride,2-chloro-5-trifluoromethyl benzenesulphonylchloride,2-chloro-5-trifluoromethyl benzenesulfonylchloride,chloro 2-chloro-5-trifluoromethyl phenyl sulfone,pubchem5106,acmc-209lcy,2-chloro-5-trifluoromethylbenzenesulfonylchloride,2-chloro-5-trifluoromethyl phenylsulfonyl chloride,4-chloro-3-trifluoromethylbenzene sulfonyl chloride PubChem CID: 2734274 IUPAC Name: 2-chloro-5-(trifluoromethyl)benzenesulfonyl chloride SMILES: C1=CC(=C(C=C1C(F)(F)F)S(=O)(=O)Cl)Cl

Pricing & Availability
Specifications

PubChem CID	2734274
CAS	54090-08-3
Molecular Weight (g/mol)	279.054
MDL Number	MFCD00052310
SMILES	C1=CC(=C(C=C1C(F)(F)F)S(=O)(=O)Cl)Cl
Synonym	2-chloro-5-trifluoromethyl benzenesulfonyl chloride,2-chloro-5-trifluoromethyl benzene-1-sulfonyl chloride,2-chloro-5-trifluoromethyl benzenesulphonylchloride,2-chloro-5-trifluoromethyl benzenesulfonylchloride,chloro 2-chloro-5-trifluoromethyl phenyl sulfone,pubchem5106,acmc-209lcy,2-chloro-5-trifluoromethylbenzenesulfonylchloride,2-chloro-5-trifluoromethyl phenylsulfonyl chloride,4-chloro-3-trifluoromethylbenzene sulfonyl chloride
IUPAC Name	2-chloro-5-(trifluoromethyl)benzenesulfonyl chloride
InChI Key	ZEYKLMDPUOVUCR-UHFFFAOYSA-N
Molecular Formula	C7H3Cl2F3O2S

4,127

3,5-Dimethoxybenzoic acid, 99%

CAS: 1132-21-4 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.18 MDL Number: MFCD00002502 InChI Key: IWPZKOJSYQZABD-UHFFFAOYSA-N Synonym: benzoic acid, 3,5-dimethoxy,unii-38my78eckk,3,5-dimethoxy benzoic acid,38my78eckk,pubchem3121,3,5-dimethoxybenzoicacid,acmc-1c4zl,3,5-dimethoxy-benzoic acid,ksc176m0p,benzoicacid, 3,5-dimethoxy PubChem CID: 14332 IUPAC Name: 3,5-dimethoxybenzoic acid SMILES: COC1=CC(=CC(OC)=C1)C(O)=O

Pricing & Availability
Specifications

PubChem CID	14332
CAS	1132-21-4
Molecular Weight (g/mol)	182.18
MDL Number	MFCD00002502
SMILES	COC1=CC(=CC(OC)=C1)C(O)=O
Synonym	benzoic acid, 3,5-dimethoxy,unii-38my78eckk,3,5-dimethoxy benzoic acid,38my78eckk,pubchem3121,3,5-dimethoxybenzoicacid,acmc-1c4zl,3,5-dimethoxy-benzoic acid,ksc176m0p,benzoicacid, 3,5-dimethoxy
IUPAC Name	3,5-dimethoxybenzoic acid
InChI Key	IWPZKOJSYQZABD-UHFFFAOYSA-N
Molecular Formula	C9H10O4

4,128

5-(2-Bromophenyl)-3-methyl-1,2,4-oxadiazole 97+%, Thermo Scientific™

CAS: 375857-64-0 Molecular Formula: C9H7BrN2O Molecular Weight (g/mol): 239.072 InChI Key: NYAFKUCVAVUCHW-UHFFFAOYSA-N PubChem CID: 18001310 IUPAC Name: 5-(2-bromophenyl)-3-methyl-1,2,4-oxadiazole SMILES: CC1=NOC(=N1)C2=CC=CC=C2Br

Pricing & Availability
Specifications

PubChem CID	18001310
CAS	375857-64-0
Molecular Weight (g/mol)	239.072
SMILES	CC1=NOC(=N1)C2=CC=CC=C2Br
IUPAC Name	5-(2-bromophenyl)-3-methyl-1,2,4-oxadiazole
InChI Key	NYAFKUCVAVUCHW-UHFFFAOYSA-N
Molecular Formula	C9H7BrN2O

4,129

4-(Aminomethyl)benzeneboronic acid pinacol ester hydrochloride, 95%

CAS: 850568-55-7 Molecular Formula: C13H21BClNO2 Molecular Weight (g/mol): 269.576 MDL Number: MFCD02179455 InChI Key: KPECMJIHZZWTJN-UHFFFAOYSA-N Synonym: 4-aminomethylphenylboronic acid, pinacol ester, hcl,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanamine hydrochloride,4-aminomethylphenylboronic acid pinacol ester hydrochloride,4-aminomethylphenylboronic acid pinacol ester hcl,4-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanamine hydrochloride,benzenemethanamine,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzylamine hydrochloride,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanamine hcl,4-aminomethylohenylboronic acid pinacl ester hcl PubChem CID: 16427088 IUPAC Name: [4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine;hydrochloride SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)CN.Cl

Pricing & Availability
Specifications

PubChem CID	16427088
CAS	850568-55-7
Molecular Weight (g/mol)	269.576
MDL Number	MFCD02179455
SMILES	B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)CN.Cl
Synonym	4-aminomethylphenylboronic acid, pinacol ester, hcl,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanamine hydrochloride,4-aminomethylphenylboronic acid pinacol ester hydrochloride,4-aminomethylphenylboronic acid pinacol ester hcl,4-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanamine hydrochloride,benzenemethanamine,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzylamine hydrochloride,4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanamine hcl,4-aminomethylohenylboronic acid pinacl ester hcl
IUPAC Name	[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanamine;hydrochloride
InChI Key	KPECMJIHZZWTJN-UHFFFAOYSA-N
Molecular Formula	C13H21BClNO2

4,130

3,5-Bis(trifluoromethyl)phenylacetonitrile, 97%

CAS: 85068-32-2 Molecular Formula: C10H5F6N Molecular Weight (g/mol): 253.15 MDL Number: MFCD00009904 InChI Key: YXGWYBUKRTYHJM-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl phenylacetonitrile,2-3,5-bis trifluoromethyl phenyl acetonitrile,3,5-bis trifluoromethyl benzyl cyanide,3,5-di trifluoromethyl benzyl cyanide,3,5-bis trifluoromethyl-phenylacetonitrile,3,5-bis trifluoromethyl phenyl acetonitrile,benzeneacetonitrile, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl benzylcyanide PubChem CID: 603657 IUPAC Name: 2-[3,5-bis(trifluoromethyl)phenyl]acetonitrile SMILES: FC(F)(F)C1=CC(=CC(CC#N)=C1)C(F)(F)F

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Specifications

PubChem CID	603657
CAS	85068-32-2
Molecular Weight (g/mol)	253.15
MDL Number	MFCD00009904
SMILES	FC(F)(F)C1=CC(=CC(CC#N)=C1)C(F)(F)F
Synonym	3,5-bis trifluoromethyl phenylacetonitrile,2-3,5-bis trifluoromethyl phenyl acetonitrile,3,5-bis trifluoromethyl benzyl cyanide,3,5-di trifluoromethyl benzyl cyanide,3,5-bis trifluoromethyl-phenylacetonitrile,3,5-bis trifluoromethyl phenyl acetonitrile,benzeneacetonitrile, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl benzylcyanide
IUPAC Name	2-[3,5-bis(trifluoromethyl)phenyl]acetonitrile
InChI Key	YXGWYBUKRTYHJM-UHFFFAOYSA-N
Molecular Formula	C10H5F6N

4,131

4-(Trifluoromethyl)phenol, 98%

CAS: 402-45-9 Molecular Formula: C₇H₅F₃O Molecular Weight (g/mol): 162.11 MDL Number: MFCD00002363 InChI Key: BAYGVMXZJBFEMB-UHFFFAOYSA-N Synonym: 4-trifluoromethyl phenol,4-hydroxybenzotrifluoride,alpha,alpha,alpha-trifluoro-p-cresol,p-trifluoromethylphenol,p-hydroxybenzotrifluoride,phenol, 4-trifluoromethyl,a,a,a-trifluoro-p-cresol,4-trifluoromethyl-phenol,para-trifluoromethylphenol PubChem CID: 67874 ChEBI: CHEBI:42578 IUPAC Name: 4-(trifluoromethyl)phenol SMILES: C1=CC(=CC=C1C(F)(F)F)O

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Specifications

PubChem CID	67874
CAS	402-45-9
Molecular Weight (g/mol)	162.11
ChEBI	CHEBI:42578
MDL Number	MFCD00002363
SMILES	C1=CC(=CC=C1C(F)(F)F)O
Synonym	4-trifluoromethyl phenol,4-hydroxybenzotrifluoride,alpha,alpha,alpha-trifluoro-p-cresol,p-trifluoromethylphenol,p-hydroxybenzotrifluoride,phenol, 4-trifluoromethyl,a,a,a-trifluoro-p-cresol,4-trifluoromethyl-phenol,para-trifluoromethylphenol
IUPAC Name	4-(trifluoromethyl)phenol
InChI Key	BAYGVMXZJBFEMB-UHFFFAOYSA-N
Molecular Formula	C₇H₅F₃O

4,132

2-Amino-5-chlorophenol, 97%

CAS: 28443-50-7 Molecular Formula: C6H6ClNO Molecular Weight (g/mol): 143.57 MDL Number: MFCD02093863 InChI Key: FZCQMIRJCGWWCL-UHFFFAOYSA-N Synonym: 4-chloro-2-hydroxyaniline,phenol, 2-amino-5-chloro,2-amino-5-chloro-phenol,5-chloro-2-aminophenol,pubchem1478,5-chloro-o-aminophenol,5-chloro-2-amino phenol,2-hydroxy-4-chloroaniline,acmc-209h2j,2-azanyl-5-chloranyl-phenol PubChem CID: 91591 ChEBI: CHEBI:75051 IUPAC Name: 2-amino-5-chlorophenol SMILES: NC1=CC=C(Cl)C=C1O

Pricing & Availability
Specifications

PubChem CID	91591
CAS	28443-50-7
Molecular Weight (g/mol)	143.57
ChEBI	CHEBI:75051
MDL Number	MFCD02093863
SMILES	NC1=CC=C(Cl)C=C1O
Synonym	4-chloro-2-hydroxyaniline,phenol, 2-amino-5-chloro,2-amino-5-chloro-phenol,5-chloro-2-aminophenol,pubchem1478,5-chloro-o-aminophenol,5-chloro-2-amino phenol,2-hydroxy-4-chloroaniline,acmc-209h2j,2-azanyl-5-chloranyl-phenol
IUPAC Name	2-amino-5-chlorophenol
InChI Key	FZCQMIRJCGWWCL-UHFFFAOYSA-N
Molecular Formula	C6H6ClNO

4,133

1,4-Dibromo-2,5-dimethoxybenzene, 98+%

CAS: 2674-34-2 Molecular Formula: C8H8Br2O2 Molecular Weight (g/mol): 295.958 MDL Number: MFCD00025694 InChI Key: CHCLRVOURKGRSW-UHFFFAOYSA-N Synonym: 2,5-dibromo-1,4-dimethoxybenzene,1,4-dibromo-2,5-dimethoxy-benzene,2,5-dibromohydroquinone dimethyl ether,benzene, 1,4-dibromo-2,5-dimethoxy,pubchem16840,acmc-209gsv,maybridge1_005131,ksc496i0h,2,5-dibromo-4-methoxyanisole,1,4-dibromo-3,6-dimethoxybenzene PubChem CID: 231240 IUPAC Name: 1,4-dibromo-2,5-dimethoxybenzene SMILES: COC1=CC(=C(C=C1Br)OC)Br

Pricing & Availability
Specifications

PubChem CID	231240
CAS	2674-34-2
Molecular Weight (g/mol)	295.958
MDL Number	MFCD00025694
SMILES	COC1=CC(=C(C=C1Br)OC)Br
Synonym	2,5-dibromo-1,4-dimethoxybenzene,1,4-dibromo-2,5-dimethoxy-benzene,2,5-dibromohydroquinone dimethyl ether,benzene, 1,4-dibromo-2,5-dimethoxy,pubchem16840,acmc-209gsv,maybridge1_005131,ksc496i0h,2,5-dibromo-4-methoxyanisole,1,4-dibromo-3,6-dimethoxybenzene
IUPAC Name	1,4-dibromo-2,5-dimethoxybenzene
InChI Key	CHCLRVOURKGRSW-UHFFFAOYSA-N
Molecular Formula	C8H8Br2O2

4,134

Ethyl 4-aminobenzoate, 98%

CAS: 94-09-7 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 MDL Number: MFCD00007892 InChI Key: BLFLLBZGZJTVJG-UHFFFAOYSA-N Synonym: benzocaine,ethyl aminobenzoate,ethyl p-aminobenzoate,americaine,anesthesin,anaesthesin,ethoform,norcaine,orthesin,parathesin PubChem CID: 2337 ChEBI: CHEBI:116735 IUPAC Name: ethyl 4-aminobenzoate SMILES: CCOC(=O)C1=CC=C(N)C=C1

Pricing & Availability
Specifications

PubChem CID	2337
CAS	94-09-7
Molecular Weight (g/mol)	165.19
ChEBI	CHEBI:116735
MDL Number	MFCD00007892
SMILES	CCOC(=O)C1=CC=C(N)C=C1
Synonym	benzocaine,ethyl aminobenzoate,ethyl p-aminobenzoate,americaine,anesthesin,anaesthesin,ethoform,norcaine,orthesin,parathesin
IUPAC Name	ethyl 4-aminobenzoate
InChI Key	BLFLLBZGZJTVJG-UHFFFAOYSA-N
Molecular Formula	C9H11NO2

4,135

1,2-Diamino-4,5-difluorobenzene, 97%

CAS: 76179-40-3 Molecular Formula: C6H6F2N2 Molecular Weight (g/mol): 144.13 MDL Number: MFCD00061131 InChI Key: PPWRHKISAQTCCG-UHFFFAOYSA-N Synonym: 1,2-diamino-4,5-difluorobenzene,4,5-difluoro-1,2-phenylenediamine,4,5-difluoro-o-phenylenediamine,2-amino-4,5-difluorophenylamine,4,5-difluoro-benzene-1,2-diamine,4,5-difluoro-1,2-benzenediamine,1,2-benzenediamine,4,5-difluoro,1,2-benzenediamine, 4,5-difluoro,pubchem4354,2-amino-4,5-difluoroaniline PubChem CID: 2736755 IUPAC Name: 4,5-difluorobenzene-1,2-diamine SMILES: NC1=CC(F)=C(F)C=C1N

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Specifications

PubChem CID	2736755
CAS	76179-40-3
Molecular Weight (g/mol)	144.13
MDL Number	MFCD00061131
SMILES	NC1=CC(F)=C(F)C=C1N
Synonym	1,2-diamino-4,5-difluorobenzene,4,5-difluoro-1,2-phenylenediamine,4,5-difluoro-o-phenylenediamine,2-amino-4,5-difluorophenylamine,4,5-difluoro-benzene-1,2-diamine,4,5-difluoro-1,2-benzenediamine,1,2-benzenediamine,4,5-difluoro,1,2-benzenediamine, 4,5-difluoro,pubchem4354,2-amino-4,5-difluoroaniline
IUPAC Name	4,5-difluorobenzene-1,2-diamine
InChI Key	PPWRHKISAQTCCG-UHFFFAOYSA-N
Molecular Formula	C6H6F2N2

4,136

2-Chloro-5-methylaniline, 98%

CAS: 95-81-8 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.60 MDL Number: MFCD00007674 InChI Key: HPSCXFOQUFPEPE-UHFFFAOYSA-N Synonym: benzenamine, 2-chloro-5-methyl,6-chloro-m-toluidine,3-amino-4-chlorotoluene,2-chlor-5-methyl-aniline,2-chloro-5-methylbenzenamine,2-chloro-5-methylphenylamine,ccris 2888,2-chloro-5-methyl aniline,6-chlor-meta-toluidin,pubchem18921 PubChem CID: 66770 IUPAC Name: 2-chloro-5-methylaniline SMILES: CC1=CC=C(Cl)C(N)=C1

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Specifications

PubChem CID	66770
CAS	95-81-8
Molecular Weight (g/mol)	141.60
MDL Number	MFCD00007674
SMILES	CC1=CC=C(Cl)C(N)=C1
Synonym	benzenamine, 2-chloro-5-methyl,6-chloro-m-toluidine,3-amino-4-chlorotoluene,2-chlor-5-methyl-aniline,2-chloro-5-methylbenzenamine,2-chloro-5-methylphenylamine,ccris 2888,2-chloro-5-methyl aniline,6-chlor-meta-toluidin,pubchem18921
IUPAC Name	2-chloro-5-methylaniline
InChI Key	HPSCXFOQUFPEPE-UHFFFAOYSA-N
Molecular Formula	C7H8ClN

4,137

2-Bromo-1,4-dichlorobenzene, 98%

CAS: 1435-50-3 Molecular Formula: C6H3BrCl2 Molecular Weight (g/mol): 225.894 MDL Number: MFCD00018505 InChI Key: OVXVQBCRONSPDC-UHFFFAOYSA-N Synonym: 1-bromo-2,5-dichlorobenzene,benzene, 2-bromo-1,4-dichloro,2,5-dichlorobromobenzene,2-bromo-1,4-dichloro-benzene,benzene, brominated chlorinated,brominated chlorinated benzene,benzene, brominated and chlorinated,pubchem3609,acmc-1bze4,intermediates-zcf02095 PubChem CID: 15033 IUPAC Name: 2-bromo-1,4-dichlorobenzene SMILES: C1=CC(=C(C=C1Cl)Br)Cl

Pricing & Availability
Specifications

PubChem CID	15033
CAS	1435-50-3
Molecular Weight (g/mol)	225.894
MDL Number	MFCD00018505
SMILES	C1=CC(=C(C=C1Cl)Br)Cl
Synonym	1-bromo-2,5-dichlorobenzene,benzene, 2-bromo-1,4-dichloro,2,5-dichlorobromobenzene,2-bromo-1,4-dichloro-benzene,benzene, brominated chlorinated,brominated chlorinated benzene,benzene, brominated and chlorinated,pubchem3609,acmc-1bze4,intermediates-zcf02095
IUPAC Name	2-bromo-1,4-dichlorobenzene
InChI Key	OVXVQBCRONSPDC-UHFFFAOYSA-N
Molecular Formula	C6H3BrCl2

4,138

Methyl 3-(bromomethyl)benzoate, 95%

CAS: 1129-28-8 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.07 MDL Number: MFCD00051437 InChI Key: YUHSMQQNPRLEEJ-UHFFFAOYSA-N Synonym: methyl 3-bromomethyl benzoate,m-carbomethoxybenzyl bromide,3-bromomethyl benzoic acid methyl ester,benzoic acid, 3-bromomethyl-, methyl ester,methyl-3-bromomethylbenzoate,methyl alpha-bromo-m-toluate,methyl3-bromomethyl benzoate,methyl-3-bromomethyl benzoate,3-carbomethoxybenzyl bromide PubChem CID: 517981 IUPAC Name: methyl 3-(bromomethyl)benzoate SMILES: COC(=O)C1=CC=CC(CBr)=C1

Pricing & Availability
Specifications

PubChem CID	517981
CAS	1129-28-8
Molecular Weight (g/mol)	229.07
MDL Number	MFCD00051437
SMILES	COC(=O)C1=CC=CC(CBr)=C1
Synonym	methyl 3-bromomethyl benzoate,m-carbomethoxybenzyl bromide,3-bromomethyl benzoic acid methyl ester,benzoic acid, 3-bromomethyl-, methyl ester,methyl-3-bromomethylbenzoate,methyl alpha-bromo-m-toluate,methyl3-bromomethyl benzoate,methyl-3-bromomethyl benzoate,3-carbomethoxybenzyl bromide
IUPAC Name	methyl 3-(bromomethyl)benzoate
InChI Key	YUHSMQQNPRLEEJ-UHFFFAOYSA-N
Molecular Formula	C9H9BrO2

4,139

N-Fmoc-L-norleucine, 98%, Thermo Scientific Chemicals

CAS: 77284-32-3 Molecular Formula: C21H23NO4 Molecular Weight (g/mol): 353.42 MDL Number: MFCD00037537 InChI Key: VCFCFPNRQDANPN-IBGZPJMESA-N Synonym: fmoc-nle-oh,fmoc-l-norleucine,n-fmoc-l-norleucine,s-2-fmoc-amino caproic acid,s-2-9h-fluoren-9-yl methoxy carbonyl amino hexanoic acid,s-2-9h-fluoren-9-ylmethoxycarbonylamino-hexanoic acid,2s-2-9h-fluoren-9-ylmethoxy carbonyl amino hexanoic acid,fmoc-norleucine,fmocnleoh,fmoc-nle PubChem CID: 7009636 IUPAC Name: (2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid SMILES: CCCC[C@H](NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O

Pricing & Availability
Specifications

PubChem CID	7009636
CAS	77284-32-3
Molecular Weight (g/mol)	353.42
MDL Number	MFCD00037537
SMILES	CCCC[C@H](NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O
Synonym	fmoc-nle-oh,fmoc-l-norleucine,n-fmoc-l-norleucine,s-2-fmoc-amino caproic acid,s-2-9h-fluoren-9-yl methoxy carbonyl amino hexanoic acid,s-2-9h-fluoren-9-ylmethoxycarbonylamino-hexanoic acid,2s-2-9h-fluoren-9-ylmethoxy carbonyl amino hexanoic acid,fmoc-norleucine,fmocnleoh,fmoc-nle
IUPAC Name	(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid
InChI Key	VCFCFPNRQDANPN-IBGZPJMESA-N
Molecular Formula	C21H23NO4

4,140

1-(Phenylsulfonyl)-1H-indol-3-ylboronic acid, 97%, May contain varying amounts of anhydri, Thermo Scientific™

CAS: 129271-98-3 Molecular Formula: C14H12BNO4S Molecular Weight (g/mol): 301.12 MDL Number: MFCD02681892 InChI Key: YKTZLHLBQGCFQX-UHFFFAOYSA-N Synonym: 1-phenylsulfonyl-3-indoleboronic acid,1-phenylsulfonyl-1h-indol-3-ylboronic acid,1-phenylsulfonyl-1h-indol-3-yl boronic acid,1-benzenesulfonyl indol-3-yl boronic acid,1-phenylsulfonylindole-3-boronic acid,1-phenylsulphonyl-1h-indole-3-boronic acid,1-phenylsulfonyl-3-indolylboronic acid,boronic acid, b-1-phenylsulfonyl-1h-indol-3-yl,1-benzenesulfonyl indol-3-ylboronic acid,1-benzenesulfonyl-1h-indol-3-yl boranediol PubChem CID: 2776217 IUPAC Name: [1-(benzenesulfonyl)indol-3-yl]boronic acid SMILES: OB(O)C1=CN(C2=CC=CC=C12)S(=O)(=O)C1=CC=CC=C1

Pricing & Availability
Specifications

PubChem CID	2776217
CAS	129271-98-3
Molecular Weight (g/mol)	301.12
MDL Number	MFCD02681892
SMILES	OB(O)C1=CN(C2=CC=CC=C12)S(=O)(=O)C1=CC=CC=C1
Synonym	1-phenylsulfonyl-3-indoleboronic acid,1-phenylsulfonyl-1h-indol-3-ylboronic acid,1-phenylsulfonyl-1h-indol-3-yl boronic acid,1-benzenesulfonyl indol-3-yl boronic acid,1-phenylsulfonylindole-3-boronic acid,1-phenylsulphonyl-1h-indole-3-boronic acid,1-phenylsulfonyl-3-indolylboronic acid,boronic acid, b-1-phenylsulfonyl-1h-indol-3-yl,1-benzenesulfonyl indol-3-ylboronic acid,1-benzenesulfonyl-1h-indol-3-yl boranediol
IUPAC Name	[1-(benzenesulfonyl)indol-3-yl]boronic acid
InChI Key	YKTZLHLBQGCFQX-UHFFFAOYSA-N
Molecular Formula	C14H12BNO4S

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