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Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.
Hydroxybenzoic Acid Derivatives (18,478)
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2,071 – 2,085 of 64,662 results
2,071
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4-Bromomandelic acid, 98+%

CAS: 6940-50-7 Molecular Formula: C8H7BrO3 Molecular Weight (g/mol): 231.05 MDL Number: MFCD00004232 InChI Key: BHZBRPQOYFDTAB-UHFFFAOYNA-N Synonym: 4-bromomandelic acid,2-4-bromophenyl-2-hydroxyacetic acid,p-bromomandelic acid,p-bromo mandelic acid,4-bromo-dl-mandelic acid,benzeneacetic acid, 4-bromo-.alpha.-hydroxy,4-bromophenyl hydroxy acetic acid,4-bromo-alpha-hydroxyphenylacetic acid,4-bromo-hydroxybenzeneaceticacid,mandelic acid, p-bromo PubChem CID: 97930 IUPAC Name: 2-(4-bromophenyl)-2-hydroxyacetic acid SMILES: OC(C(O)=O)C1=CC=C(Br)C=C1

PubChem CID 97930
CAS 6940-50-7
Molecular Weight (g/mol) 231.05
MDL Number MFCD00004232
SMILES OC(C(O)=O)C1=CC=C(Br)C=C1
Synonym 4-bromomandelic acid,2-4-bromophenyl-2-hydroxyacetic acid,p-bromomandelic acid,p-bromo mandelic acid,4-bromo-dl-mandelic acid,benzeneacetic acid, 4-bromo-.alpha.-hydroxy,4-bromophenyl hydroxy acetic acid,4-bromo-alpha-hydroxyphenylacetic acid,4-bromo-hydroxybenzeneaceticacid,mandelic acid, p-bromo
IUPAC Name 2-(4-bromophenyl)-2-hydroxyacetic acid
InChI Key BHZBRPQOYFDTAB-UHFFFAOYNA-N
Molecular Formula C8H7BrO3
2,072
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1-(4-Fluorophenyl)-1-methylethylamine, 97%

CAS: 17797-10-3 Molecular Formula: C9H12FN Molecular Weight (g/mol): 153.20 MDL Number: MFCD07777176 InChI Key: NYFSRXOWJXAHOO-UHFFFAOYSA-N Synonym: 2-4-fluorophenyl propan-2-amine,1-4-fluorophenyl-1-methylethylamine,1-4-fluorophenyl-1-methyl-ethylamine,1-4-fluoro-phenyl-1-methyl-ethylamine,2-4-fluorophenyl prop-2-ylamine,1-methyl-1-4-fluorophenyl ethylamine,4-fluorocumylamine,pubchem16914,4-fluoro-alpha,alpha-dimethylbenzylamine,alpha,alpha-dimethyl-4-fluorobenzylamine PubChem CID: 13025665 IUPAC Name: 2-(4-fluorophenyl)propan-2-amine SMILES: CC(C)(N)C1=CC=C(F)C=C1

PubChem CID 13025665
CAS 17797-10-3
Molecular Weight (g/mol) 153.20
MDL Number MFCD07777176
SMILES CC(C)(N)C1=CC=C(F)C=C1
Synonym 2-4-fluorophenyl propan-2-amine,1-4-fluorophenyl-1-methylethylamine,1-4-fluorophenyl-1-methyl-ethylamine,1-4-fluoro-phenyl-1-methyl-ethylamine,2-4-fluorophenyl prop-2-ylamine,1-methyl-1-4-fluorophenyl ethylamine,4-fluorocumylamine,pubchem16914,4-fluoro-alpha,alpha-dimethylbenzylamine,alpha,alpha-dimethyl-4-fluorobenzylamine
IUPAC Name 2-(4-fluorophenyl)propan-2-amine
InChI Key NYFSRXOWJXAHOO-UHFFFAOYSA-N
Molecular Formula C9H12FN
2,073

3-[(6-Methylpyrazin-2-yl)oxy]benzylamine, 97%, Thermo Scientific™

CAS: 941716-89-8 Molecular Formula: C12H13N3O Molecular Weight (g/mol): 215.256 MDL Number: MFCD09817526 InChI Key: PJVRJIDLKXDROC-UHFFFAOYSA-N Synonym: 3-6-methylpyrazin-2-yl oxy benzylamine,3-6-methylpyrazin-2-yl oxy phenyl methanamine,1-3-6-methylpyrazin-2-yl oxy phenyl methanamine,3-6-methylpyrazin-2-yloxy phenyl methylamine,3-6-methylpyrazin-2-yl oxy phenyl methylamine PubChem CID: 24229681 IUPAC Name: [3-(6-methylpyrazin-2-yl)oxyphenyl]methanamine SMILES: CC1=CN=CC(=N1)OC2=CC=CC(=C2)CN

PubChem CID 24229681
CAS 941716-89-8
Molecular Weight (g/mol) 215.256
MDL Number MFCD09817526
SMILES CC1=CN=CC(=N1)OC2=CC=CC(=C2)CN
Synonym 3-6-methylpyrazin-2-yl oxy benzylamine,3-6-methylpyrazin-2-yl oxy phenyl methanamine,1-3-6-methylpyrazin-2-yl oxy phenyl methanamine,3-6-methylpyrazin-2-yloxy phenyl methylamine,3-6-methylpyrazin-2-yl oxy phenyl methylamine
IUPAC Name [3-(6-methylpyrazin-2-yl)oxyphenyl]methanamine
InChI Key PJVRJIDLKXDROC-UHFFFAOYSA-N
Molecular Formula C12H13N3O
2,074
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2-Hydroxybenzophenone, 99%

CAS: 117-99-7 Molecular Formula: C13H10O2 Molecular Weight (g/mol): 198.221 MDL Number: MFCD00002216 InChI Key: HJIAMFHSAAEUKR-UHFFFAOYSA-N Synonym: 2-hydroxybenzophenone,o-benzoylphenol,2-hydroxyphenyl phenyl methanone,o-hydroxybenzophenone,benzophenone, 2-hydroxy,methanone, 2-hydroxyphenyl phenyl,phenyl 2-hydroxyphenyl ketone,unii-lqv22w4v05,ortho-hydroxybenzophenone,2-hydroxyphenyl phenylmethanone PubChem CID: 8348 IUPAC Name: (2-hydroxyphenyl)-phenylmethanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=C2O

PubChem CID 8348
CAS 117-99-7
Molecular Weight (g/mol) 198.221
MDL Number MFCD00002216
SMILES C1=CC=C(C=C1)C(=O)C2=CC=CC=C2O
Synonym 2-hydroxybenzophenone,o-benzoylphenol,2-hydroxyphenyl phenyl methanone,o-hydroxybenzophenone,benzophenone, 2-hydroxy,methanone, 2-hydroxyphenyl phenyl,phenyl 2-hydroxyphenyl ketone,unii-lqv22w4v05,ortho-hydroxybenzophenone,2-hydroxyphenyl phenylmethanone
IUPAC Name (2-hydroxyphenyl)-phenylmethanone
InChI Key HJIAMFHSAAEUKR-UHFFFAOYSA-N
Molecular Formula C13H10O2
2,075

4-(Morpholine-4-sulfonyl)-benzenesulfonyl chloride, Technical Grade, Thermo Scientific™

CAS: 465514-13-0 Molecular Formula: C10H12ClNO5S2 Molecular Weight (g/mol): 325.778 InChI Key: ZZSBUDUHESWZJB-UHFFFAOYSA-N Synonym: 4-morpholin-4-ylsulfonyl benzenesulfonyl chloride,4-morpholine-4-sulfonyl benzene-1-sulfonyl chloride,4-morpholinosulfonyl benzene-1-sulfonyl chloride,4-morpholine-4-sulfonyl benzenesulfonyl chloride,4-morpholine-4-sulfonyl-benzenesulfonyl chloride,4-morpholine-4-sulfonyl phenylsulfonyl chloride,4-morpholine-4-sulfonyl-benzenesulfonylchloride PubChem CID: 2779790 IUPAC Name: 4-morpholin-4-ylsulfonylbenzenesulfonyl chloride SMILES: C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)Cl

PubChem CID 2779790
CAS 465514-13-0
Molecular Weight (g/mol) 325.778
SMILES C1COCCN1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)Cl
Synonym 4-morpholin-4-ylsulfonyl benzenesulfonyl chloride,4-morpholine-4-sulfonyl benzene-1-sulfonyl chloride,4-morpholinosulfonyl benzene-1-sulfonyl chloride,4-morpholine-4-sulfonyl benzenesulfonyl chloride,4-morpholine-4-sulfonyl-benzenesulfonyl chloride,4-morpholine-4-sulfonyl phenylsulfonyl chloride,4-morpholine-4-sulfonyl-benzenesulfonylchloride
IUPAC Name 4-morpholin-4-ylsulfonylbenzenesulfonyl chloride
InChI Key ZZSBUDUHESWZJB-UHFFFAOYSA-N
Molecular Formula C10H12ClNO5S2
2,076

Thermo Scientific Chemicals Cyclizine hydrochloride, 98%

CAS: 303-25-3 Molecular Formula: C18H22N2·HCl Molecular Weight (g/mol): 302.84 InChI Key: UKPBEPCQTDRZSE-UHFFFAOYSA-N Synonym: cyclizine hydrochloride,cyclizine hcl,dihydrochlorid,marzine,reis-fit,unii-w0o1nhp4we,marezine hydrochloride,cyclizine monohydrochloride,w0o1nhp4we,1-diphenylmethyl-4-methylpiperazine monohydrochloride PubChem CID: 6420019 ChEBI: CHEBI:51045 IUPAC Name: 1-benzhydryl-4-methylpiperazine;hydrochloride SMILES: CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3.Cl

PubChem CID 6420019
CAS 303-25-3
Molecular Weight (g/mol) 302.84
ChEBI CHEBI:51045
SMILES CN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3.Cl
Synonym cyclizine hydrochloride,cyclizine hcl,dihydrochlorid,marzine,reis-fit,unii-w0o1nhp4we,marezine hydrochloride,cyclizine monohydrochloride,w0o1nhp4we,1-diphenylmethyl-4-methylpiperazine monohydrochloride
IUPAC Name 1-benzhydryl-4-methylpiperazine;hydrochloride
InChI Key UKPBEPCQTDRZSE-UHFFFAOYSA-N
Molecular Formula C18H22N2·HCl
2,077

N-Methyl-2-(phenoxymethyl)benzylamine, 97%, Thermo Scientific™

CAS: 892502-17-9 Molecular Formula: C15H17NO Molecular Weight (g/mol): 227.307 MDL Number: MFCD09025894 InChI Key: WFUPXVCKIKJBIM-UHFFFAOYSA-N Synonym: n-methyl-2-phenoxymethyl benzylamine,methyl 2-phenoxymethyl phenyl methyl amine,n-methyl-1-2-phenoxymethyl phenyl methanamine,benzenemethanamine,n-methyl-2-phenoxymethyl PubChem CID: 18525895 IUPAC Name: N-methyl-1-[2-(phenoxymethyl)phenyl]methanamine SMILES: CNCC1=CC=CC=C1COC2=CC=CC=C2

PubChem CID 18525895
CAS 892502-17-9
Molecular Weight (g/mol) 227.307
MDL Number MFCD09025894
SMILES CNCC1=CC=CC=C1COC2=CC=CC=C2
Synonym n-methyl-2-phenoxymethyl benzylamine,methyl 2-phenoxymethyl phenyl methyl amine,n-methyl-1-2-phenoxymethyl phenyl methanamine,benzenemethanamine,n-methyl-2-phenoxymethyl
IUPAC Name N-methyl-1-[2-(phenoxymethyl)phenyl]methanamine
InChI Key WFUPXVCKIKJBIM-UHFFFAOYSA-N
Molecular Formula C15H17NO
2,078
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3-Chloro-5-fluorobenzeneboronic acid, 95%

CAS: 328956-61-2 Molecular Formula: C6H5BClFO2 Molecular Weight (g/mol): 174.36 MDL Number: MFCD06801741 InChI Key: XYQDHVBKUNNLGZ-UHFFFAOYSA-N Synonym: 3-chloro-5-fluorobenzeneboronic acid,3-chloro-5-fluorophenyl boronic acid,boronic acid, 3-chloro-5-fluorophenyl,pubchem6363,acmc-1agjy,ksc497k5n,3-borono-5-fluorochlorobenzene,3-chloro-5-fluoro-benzeneboronic acid,3-chloro-5-fluoro-phenyl boronic acid,3-chloranyl-5-fluoranyl-phenyl boronic acid PubChem CID: 15391287 IUPAC Name: (3-chloro-5-fluorophenyl)boronic acid SMILES: OB(O)C1=CC(F)=CC(Cl)=C1

PubChem CID 15391287
CAS 328956-61-2
Molecular Weight (g/mol) 174.36
MDL Number MFCD06801741
SMILES OB(O)C1=CC(F)=CC(Cl)=C1
Synonym 3-chloro-5-fluorobenzeneboronic acid,3-chloro-5-fluorophenyl boronic acid,boronic acid, 3-chloro-5-fluorophenyl,pubchem6363,acmc-1agjy,ksc497k5n,3-borono-5-fluorochlorobenzene,3-chloro-5-fluoro-benzeneboronic acid,3-chloro-5-fluoro-phenyl boronic acid,3-chloranyl-5-fluoranyl-phenyl boronic acid
IUPAC Name (3-chloro-5-fluorophenyl)boronic acid
InChI Key XYQDHVBKUNNLGZ-UHFFFAOYSA-N
Molecular Formula C6H5BClFO2
2,079
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Ethyltriphenylphosphonium bromide, 98%

CAS: 1530-32-1 Molecular Formula: C20H20BrP Molecular Weight (g/mol): 371.26 MDL Number: MFCD00011838 InChI Key: JHYNXXDQQHTCHJ-UHFFFAOYSA-M Synonym: ethyltriphenylphosphonium bromide,ethyl triphenyl phosphonium bromide,triphenylethylphosphonium bromide,phosphonium, ethyltriphenyl-, bromide,ethyltriphenylphosphanium bromide,ethyl triphenylphosphonium bromide,unii-r85v84ul5v,ethyltriphenylphosphoniumbromide,guaifenesin powder,pubchem18705 PubChem CID: 73727 IUPAC Name: ethyl(triphenyl)phosphanium;bromide SMILES: [Br-].CC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 73727
CAS 1530-32-1
Molecular Weight (g/mol) 371.26
MDL Number MFCD00011838
SMILES [Br-].CC[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym ethyltriphenylphosphonium bromide,ethyl triphenyl phosphonium bromide,triphenylethylphosphonium bromide,phosphonium, ethyltriphenyl-, bromide,ethyltriphenylphosphanium bromide,ethyl triphenylphosphonium bromide,unii-r85v84ul5v,ethyltriphenylphosphoniumbromide,guaifenesin powder,pubchem18705
IUPAC Name ethyl(triphenyl)phosphanium;bromide
InChI Key JHYNXXDQQHTCHJ-UHFFFAOYSA-M
Molecular Formula C20H20BrP
2,080
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4-Bromobenzoic acid, 97%

CAS: 586-76-5 Molecular Formula: C7H5BrO2 Molecular Weight (g/mol): 201.02 MDL Number: MFCD00002529 InChI Key: TUXYZHVUPGXXQG-UHFFFAOYSA-N Synonym: p-bromobenzoic acid,benzoic acid, 4-bromo,p-carboxybromobenzene,benzoic acid, p-bromo,p-bromobenzenecarboxylic acid,4-bromo-benzoic acid,4-brom-benzoesaeure,4-carboxybromobenzene,para bromo benzoic acid,4bromo-benzoic acid PubChem CID: 11464 ChEBI: CHEBI:60698 IUPAC Name: 4-bromobenzoic acid SMILES: OC(=O)C1=CC=C(Br)C=C1

PubChem CID 11464
CAS 586-76-5
Molecular Weight (g/mol) 201.02
ChEBI CHEBI:60698
MDL Number MFCD00002529
SMILES OC(=O)C1=CC=C(Br)C=C1
Synonym p-bromobenzoic acid,benzoic acid, 4-bromo,p-carboxybromobenzene,benzoic acid, p-bromo,p-bromobenzenecarboxylic acid,4-bromo-benzoic acid,4-brom-benzoesaeure,4-carboxybromobenzene,para bromo benzoic acid,4bromo-benzoic acid
IUPAC Name 4-bromobenzoic acid
InChI Key TUXYZHVUPGXXQG-UHFFFAOYSA-N
Molecular Formula C7H5BrO2
2,081
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Albuterol Sulfate, USP, 98.5-101%, Spectrum™ Chemical
SDP

CAS: 51022-70-9 Molecular Formula: C26H44N2O10S Molecular Weight (g/mol): 576.70 InChI Key: BNPSSFBOAGDEEL-UHFFFAOYNA-N IUPAC Name: bis(4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol); sulfuric acid SMILES: OS(O)(=O)=O.CC(C)(C)NCC(O)C1=CC=C(O)C(CO)=C1.CC(C)(C)NCC(O)C1=CC=C(O)C(CO)=C1

CAS 51022-70-9
Molecular Weight (g/mol) 576.70
SMILES OS(O)(=O)=O.CC(C)(C)NCC(O)C1=CC=C(O)C(CO)=C1.CC(C)(C)NCC(O)C1=CC=C(O)C(CO)=C1
IUPAC Name bis(4-[2-(tert-butylamino)-1-hydroxyethyl]-2-(hydroxymethyl)phenol); sulfuric acid
InChI Key BNPSSFBOAGDEEL-UHFFFAOYNA-N
Molecular Formula C26H44N2O10S
2,082

MP Biomedicals™ FLUCONAZOLE

Selective inhibitor of fungal cytochrome P-450 sterol C-14 α-demethylation

2,083
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3,5-Bis(trifluoromethyl)-o-phenylenediamine, 97%

CAS: 367-65-7 Molecular Formula: C8H6F6N2 Molecular Weight (g/mol): 244.14 MDL Number: MFCD01631430 InChI Key: BRLIJPMFMGTIAW-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl-1,2-diaminobenzene,3,5-bis trifluoromethyl benzene-1,2-diamine,3,5-bis trifluoromethyl-1,2-phenylenediamine,1,2-diamino-3,5-bis trifluoromethyl benzene,1,2-benzenediamine, 3,5-bis trifluoromethyl,acmc-1cr3d,3,5-bis trifluoromethyl-o-phenylenediamine,1,2-benzenediamine,3,5-bis trifluoromethyl,3,5-bis trifluoromethyl phenylene-1,2-diamine PubChem CID: 2773214 IUPAC Name: 3,5-bis(trifluoromethyl)benzene-1,2-diamine SMILES: NC1=CC(=CC(=C1N)C(F)(F)F)C(F)(F)F

PubChem CID 2773214
CAS 367-65-7
Molecular Weight (g/mol) 244.14
MDL Number MFCD01631430
SMILES NC1=CC(=CC(=C1N)C(F)(F)F)C(F)(F)F
Synonym 3,5-bis trifluoromethyl-1,2-diaminobenzene,3,5-bis trifluoromethyl benzene-1,2-diamine,3,5-bis trifluoromethyl-1,2-phenylenediamine,1,2-diamino-3,5-bis trifluoromethyl benzene,1,2-benzenediamine, 3,5-bis trifluoromethyl,acmc-1cr3d,3,5-bis trifluoromethyl-o-phenylenediamine,1,2-benzenediamine,3,5-bis trifluoromethyl,3,5-bis trifluoromethyl phenylene-1,2-diamine
IUPAC Name 3,5-bis(trifluoromethyl)benzene-1,2-diamine
InChI Key BRLIJPMFMGTIAW-UHFFFAOYSA-N
Molecular Formula C8H6F6N2
2,084
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2,4-Dinitrophenylhydrazine, Spectrum™ Chemical
SDP

CAS: 119-26-6 Molecular Formula: C6H6N4O4 Molecular Weight (g/mol): 198.14 InChI Key: HORQAOAYAYGIBM-UHFFFAOYSA-N IUPAC Name: (2,4-dinitrophenyl)hydrazine SMILES: NNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O

CAS 119-26-6
Molecular Weight (g/mol) 198.14
SMILES NNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O
IUPAC Name (2,4-dinitrophenyl)hydrazine
InChI Key HORQAOAYAYGIBM-UHFFFAOYSA-N
Molecular Formula C6H6N4O4
2,085
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2-Iodobenzoic acid, 98%

CAS: 88-67-5 Molecular Formula: C7H5IO2 Molecular Weight (g/mol): 248.01 InChI Key: CJNZAXGUTKBIHP-UHFFFAOYSA-N Synonym: o-iodobenzoic acid,benzoic acid, 2-iodo,iodobenzoic acid,benzoic acid, o-iodo,usaf ek-572,2-iodo benzoic acid,2-iodo-benzoic acid,benzoic acid, iodo,kyselina o-jodbenzoova,o-jod-benzoesaeure PubChem CID: 6941 ChEBI: CHEBI:287979 IUPAC Name: 2-iodobenzoic acid SMILES: C1=CC=C(C(=C1)C(=O)O)I

PubChem CID 6941
CAS 88-67-5
Molecular Weight (g/mol) 248.01
ChEBI CHEBI:287979
SMILES C1=CC=C(C(=C1)C(=O)O)I
Synonym o-iodobenzoic acid,benzoic acid, 2-iodo,iodobenzoic acid,benzoic acid, o-iodo,usaf ek-572,2-iodo benzoic acid,2-iodo-benzoic acid,benzoic acid, iodo,kyselina o-jodbenzoova,o-jod-benzoesaeure
IUPAC Name 2-iodobenzoic acid
InChI Key CJNZAXGUTKBIHP-UHFFFAOYSA-N
Molecular Formula C7H5IO2