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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 (13,221)
Aminobenzoic acids and derivatives (8,773)
Phenylpropenes (4,928)
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241 – 255 of 54,507 results
241

Ethyl 2-chlorobenzoate, 98%

CAS: 7335-25-3 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.62 MDL Number: MFCD00016338 InChI Key: RETLCWPMLJPOTP-UHFFFAOYSA-N Synonym: 2-chlorobenzoic acid ethyl ester,ethyl o-chlorobenzoate,benzoic acid, 2-chloro-, ethyl ester,ethyl-2-chlorobenzoate,ethyl2-chlorobenzoate,pubchem3703,acmc-1bfxj,ethyl 2-chloranylbenzoate,chlorobenzoic acid ethyl ester,ksc498a5r PubChem CID: 81783 IUPAC Name: ethyl 2-chlorobenzoate SMILES: CCOC(=O)C1=CC=CC=C1Cl

PubChem CID 81783
CAS 7335-25-3
Molecular Weight (g/mol) 184.62
MDL Number MFCD00016338
SMILES CCOC(=O)C1=CC=CC=C1Cl
Synonym 2-chlorobenzoic acid ethyl ester,ethyl o-chlorobenzoate,benzoic acid, 2-chloro-, ethyl ester,ethyl-2-chlorobenzoate,ethyl2-chlorobenzoate,pubchem3703,acmc-1bfxj,ethyl 2-chloranylbenzoate,chlorobenzoic acid ethyl ester,ksc498a5r
IUPAC Name ethyl 2-chlorobenzoate
InChI Key RETLCWPMLJPOTP-UHFFFAOYSA-N
Molecular Formula C9H9ClO2
242

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

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
243

Dicyclohexyl phthalate, 99%

CAS: 84-61-7 Molecular Formula: C20H26O4 Molecular Weight (g/mol): 330.42 MDL Number: MFCD00003849 InChI Key: VOWAEIGWURALJQ-UHFFFAOYSA-N Synonym: dicyclohexyl phthalate,ergoplast fdc,unimoll 66,ergoplast.fdc,howflex cp,phthalic acid, dicyclohexyl ester,phthalic acid dicyclohexyl ester,1,2-benzenedicarboxylic acid, dicyclohexyl ester,unii-cgd15m7h2n,ccris 6190 PubChem CID: 6777 ChEBI: CHEBI:34693 IUPAC Name: dicyclohexyl benzene-1,2-dicarboxylate SMILES: C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3

PubChem CID 6777
CAS 84-61-7
Molecular Weight (g/mol) 330.42
ChEBI CHEBI:34693
MDL Number MFCD00003849
SMILES C1CCC(CC1)OC(=O)C2=CC=CC=C2C(=O)OC3CCCCC3
Synonym dicyclohexyl phthalate,ergoplast fdc,unimoll 66,ergoplast.fdc,howflex cp,phthalic acid, dicyclohexyl ester,phthalic acid dicyclohexyl ester,1,2-benzenedicarboxylic acid, dicyclohexyl ester,unii-cgd15m7h2n,ccris 6190
IUPAC Name dicyclohexyl benzene-1,2-dicarboxylate
InChI Key VOWAEIGWURALJQ-UHFFFAOYSA-N
Molecular Formula C20H26O4
244

4-Bromobenzaldehyde 97.0+%, TCI America™
SDP

CAS: 1122-91-4 Molecular Formula: C7H5BrO Molecular Weight (g/mol): 185.02 MDL Number: MFCD00003377 InChI Key: ZRYZBQLXDKPBDU-UHFFFAOYSA-N Synonym: p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd PubChem CID: 70741 IUPAC Name: 4-bromobenzaldehyde SMILES: C1=CC(=CC=C1C=O)Br

PubChem CID 70741
CAS 1122-91-4
Molecular Weight (g/mol) 185.02
MDL Number MFCD00003377
SMILES C1=CC(=CC=C1C=O)Br
Synonym p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd
IUPAC Name 4-bromobenzaldehyde
InChI Key ZRYZBQLXDKPBDU-UHFFFAOYSA-N
Molecular Formula C7H5BrO
245

m-Toluic acid, 99%

CAS: 99-04-7 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002523 InChI Key: GPSDUZXPYCFOSQ-UHFFFAOYSA-N Synonym: m-toluic acid,m-toluylic acid,3-toluic acid,benzoic acid, 3-methyl,meta-toluic acid,m-methylbenzoic acid,beta-methylbenzoic acid,3-methyl-benzoic acid,beta-bethylbenzoic acid,unii-1ua7k8eext PubChem CID: 7418 ChEBI: CHEBI:10589 IUPAC Name: 3-methylbenzoic acid SMILES: CC1=CC=CC(=C1)C(O)=O

PubChem CID 7418
CAS 99-04-7
Molecular Weight (g/mol) 136.15
ChEBI CHEBI:10589
MDL Number MFCD00002523
SMILES CC1=CC=CC(=C1)C(O)=O
Synonym m-toluic acid,m-toluylic acid,3-toluic acid,benzoic acid, 3-methyl,meta-toluic acid,m-methylbenzoic acid,beta-methylbenzoic acid,3-methyl-benzoic acid,beta-bethylbenzoic acid,unii-1ua7k8eext
IUPAC Name 3-methylbenzoic acid
InChI Key GPSDUZXPYCFOSQ-UHFFFAOYSA-N
Molecular Formula C8H8O2
246

4-Chlorobenzophenone, 99%

CAS: 134-85-0 Molecular Formula: C13H9ClO Molecular Weight (g/mol): 216.664 MDL Number: MFCD00000622 InChI Key: UGVRJVHOJNYEHR-UHFFFAOYSA-N Synonym: 4-chlorobenzophenone,4-chlorophenyl phenyl methanone,p-chlorobenzophenone,methanone, 4-chlorophenyl phenyl,benzophenone, 4-chloro,p-cbp,unii-wih1iz728u,4-chloro benzophenone,4-chlorophenyl-phenylmethanone,wih1iz728u PubChem CID: 8653 IUPAC Name: (4-chlorophenyl)-phenylmethanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl

PubChem CID 8653
CAS 134-85-0
Molecular Weight (g/mol) 216.664
MDL Number MFCD00000622
SMILES C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl
Synonym 4-chlorobenzophenone,4-chlorophenyl phenyl methanone,p-chlorobenzophenone,methanone, 4-chlorophenyl phenyl,benzophenone, 4-chloro,p-cbp,unii-wih1iz728u,4-chloro benzophenone,4-chlorophenyl-phenylmethanone,wih1iz728u
IUPAC Name (4-chlorophenyl)-phenylmethanone
InChI Key UGVRJVHOJNYEHR-UHFFFAOYSA-N
Molecular Formula C13H9ClO
247

Benzyl bromide, 98%

CAS: 100-39-0 MDL Number: MFCD00000172 InChI Key: AGEZXYOZHKGVCM-UHFFFAOYSA-N Synonym: benzyl bromide,bromomethyl benzene,alpha-bromotoluene,bromophenylmethane,benzene, bromomethyl,phenylmethyl bromide,1-bromotoluene,benzylbromide,cyclite PubChem CID: 7498 ChEBI: CHEBI:59858 IUPAC Name: bromomethylbenzene SMILES: C1=CC=C(C=C1)CBr

PubChem CID 7498
CAS 100-39-0
ChEBI CHEBI:59858
MDL Number MFCD00000172
SMILES C1=CC=C(C=C1)CBr
Synonym benzyl bromide,bromomethyl benzene,alpha-bromotoluene,bromophenylmethane,benzene, bromomethyl,phenylmethyl bromide,1-bromotoluene,benzylbromide,cyclite
IUPAC Name bromomethylbenzene
InChI Key AGEZXYOZHKGVCM-UHFFFAOYSA-N
248

2,4-Dinitrophenylhydrazine Hydrochloride 98.0+%, TCI America™
SDP

CAS: 55907-61-4 Molecular Formula: C6H7ClN4O4 Molecular Weight (g/mol): 234.60 MDL Number: MFCD00050688 InChI Key: PUYFAZQODQZOFK-UHFFFAOYSA-N PubChem CID: 5463312 IUPAC Name: hydrogen (2,4-dinitrophenyl)hydrazine chloride SMILES: [H+].[Cl-].NNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O

PubChem CID 5463312
CAS 55907-61-4
Molecular Weight (g/mol) 234.60
MDL Number MFCD00050688
SMILES [H+].[Cl-].NNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O
IUPAC Name hydrogen (2,4-dinitrophenyl)hydrazine chloride
InChI Key PUYFAZQODQZOFK-UHFFFAOYSA-N
Molecular Formula C6H7ClN4O4
249

Thermo Scientific Chemicals Fluconazole, 98%

CAS: 86386-73-4 Molecular Formula: C13H12F2N6O Molecular Weight (g/mol): 306.27 InChI Key: RFHAOTPXVQNOHP-UHFFFAOYSA-N Synonym: fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol PubChem CID: 3365 ChEBI: CHEBI:46081 IUPAC Name: 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol SMILES: C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O

PubChem CID 3365
CAS 86386-73-4
Molecular Weight (g/mol) 306.27
ChEBI CHEBI:46081
SMILES C1=CC(=C(C=C1F)F)C(CN2C=NC=N2)(CN3C=NC=N3)O
Synonym fluconazole,diflucan,triflucan,elazor,biozolene,biocanol,fungata,fluconazol,fluconazolum,flucazol
IUPAC Name 2-(2,4-difluorophenyl)-1,3-bis(1,2,4-triazol-1-yl)propan-2-ol
InChI Key RFHAOTPXVQNOHP-UHFFFAOYSA-N
Molecular Formula C13H12F2N6O
250

tert-Butylhydroquinone, 97%

CAS: 1948-33-0 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00002344 InChI Key: BGNXCDMCOKJUMV-UHFFFAOYSA-N Synonym: tert-butylhydroquinone,tbhq,2-tert-butylhydroquinone,t-butylhydroquinone,mtbhq,t-butyl hydroquinone,2-tert-butyl-1,4-benzenediol,2-t-butylhydroquinone,mono-tert-butylhydroquinone,sustane PubChem CID: 16043 ChEBI: CHEBI:78886 IUPAC Name: 2-tert-butylbenzene-1,4-diol SMILES: CC(C)(C)C1=C(C=CC(=C1)O)O

PubChem CID 16043
CAS 1948-33-0
Molecular Weight (g/mol) 166.22
ChEBI CHEBI:78886
MDL Number MFCD00002344
SMILES CC(C)(C)C1=C(C=CC(=C1)O)O
Synonym tert-butylhydroquinone,tbhq,2-tert-butylhydroquinone,t-butylhydroquinone,mtbhq,t-butyl hydroquinone,2-tert-butyl-1,4-benzenediol,2-t-butylhydroquinone,mono-tert-butylhydroquinone,sustane
IUPAC Name 2-tert-butylbenzene-1,4-diol
InChI Key BGNXCDMCOKJUMV-UHFFFAOYSA-N
Molecular Formula C10H14O2
251

4,4'-Diaminodiphenylmethane, 97%, Thermo Scientific Chemicals

CAS: 101-77-9 Molecular Formula: C13H14N2 Molecular Weight (g/mol): 198.27 MDL Number: MFCD00007914 InChI Key: YBRVSVVVWCFQMG-UHFFFAOYSA-N Synonym: 4,4'-methylenedianiline,4,4'-diaminodiphenylmethane,dadpm,methylenedianiline,dianilinomethane,tonox,p,p'-methylenedianiline,dianilinemethane,bis 4-aminophenyl methane,4-4-aminobenzyl aniline PubChem CID: 7577 ChEBI: CHEBI:32506 IUPAC Name: 4-[(4-aminophenyl)methyl]aniline SMILES: NC1=CC=C(CC2=CC=C(N)C=C2)C=C1

PubChem CID 7577
CAS 101-77-9
Molecular Weight (g/mol) 198.27
ChEBI CHEBI:32506
MDL Number MFCD00007914
SMILES NC1=CC=C(CC2=CC=C(N)C=C2)C=C1
Synonym 4,4'-methylenedianiline,4,4'-diaminodiphenylmethane,dadpm,methylenedianiline,dianilinomethane,tonox,p,p'-methylenedianiline,dianilinemethane,bis 4-aminophenyl methane,4-4-aminobenzyl aniline
IUPAC Name 4-[(4-aminophenyl)methyl]aniline
InChI Key YBRVSVVVWCFQMG-UHFFFAOYSA-N
Molecular Formula C13H14N2
252

Anthranilamide, 99+%

CAS: 88-68-6 Molecular Formula: C7H8N2O Molecular Weight (g/mol): 136.15 MDL Number: MFCD00007981 InChI Key: PXBFMLJZNCDSMP-UHFFFAOYSA-N Synonym: anthranilamide,benzamide, 2-amino,o-aminobenzamide,2-carbamoylaniline,aminobenzamide,anthranilimidic acid,benzamide, o-amino,anthranilic acid amide,anthranilamide van,o-aminobenzamide van PubChem CID: 6942 IUPAC Name: 2-aminobenzamide SMILES: C1=CC=C(C(=C1)C(=O)N)N

PubChem CID 6942
CAS 88-68-6
Molecular Weight (g/mol) 136.15
MDL Number MFCD00007981
SMILES C1=CC=C(C(=C1)C(=O)N)N
Synonym anthranilamide,benzamide, 2-amino,o-aminobenzamide,2-carbamoylaniline,aminobenzamide,anthranilimidic acid,benzamide, o-amino,anthranilic acid amide,anthranilamide van,o-aminobenzamide van
IUPAC Name 2-aminobenzamide
InChI Key PXBFMLJZNCDSMP-UHFFFAOYSA-N
Molecular Formula C7H8N2O
253

3-Bromobenzaldehyde, 97%

CAS: 3132-99-8 Molecular Formula: C7H5BrO Molecular Weight (g/mol): 185.02 MDL Number: MFCD00003345 InChI Key: SUISZCALMBHJQX-UHFFFAOYSA-N Synonym: m-bromobenzaldehyde,benzaldehyde, 3-bromo,benzaldehyde, m-bromo,3-bromobenzeldehyde,unii-w0ard2zj82,3-bromo benzaldehyde,3-bromo-benzaldehyde,w0ard2zj82,benzaldehyde, m-bromo-6ci,7ci,8ci,3-bromobenzaidehyde PubChem CID: 76583 IUPAC Name: 3-bromobenzaldehyde SMILES: C1=CC(=CC(=C1)Br)C=O

PubChem CID 76583
CAS 3132-99-8
Molecular Weight (g/mol) 185.02
MDL Number MFCD00003345
SMILES C1=CC(=CC(=C1)Br)C=O
Synonym m-bromobenzaldehyde,benzaldehyde, 3-bromo,benzaldehyde, m-bromo,3-bromobenzeldehyde,unii-w0ard2zj82,3-bromo benzaldehyde,3-bromo-benzaldehyde,w0ard2zj82,benzaldehyde, m-bromo-6ci,7ci,8ci,3-bromobenzaidehyde
IUPAC Name 3-bromobenzaldehyde
InChI Key SUISZCALMBHJQX-UHFFFAOYSA-N
Molecular Formula C7H5BrO
254

Niclosamide, 97+%, Thermo Scientific Chemicals

CAS: 50-65-7 Molecular Formula: C13H8Cl2N2O4 Molecular Weight (g/mol): 327.12 MDL Number: MFCD00057597 InChI Key: RJMUSRYZPJIFPJ-UHFFFAOYSA-N Synonym: niclosamide,5-chloro-n-2-chloro-4-nitrophenyl-2-hydroxybenzamide,niclocide,bayluscid,phenasal,tredemine,fenasal,yomesan,dichlosale,helmiantin PubChem CID: 4477 IUPAC Name: 5-chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide SMILES: OC1=CC=C(Cl)C=C1C(=O)NC1=CC=C(C=C1Cl)[N+]([O-])=O

PubChem CID 4477
CAS 50-65-7
Molecular Weight (g/mol) 327.12
MDL Number MFCD00057597
SMILES OC1=CC=C(Cl)C=C1C(=O)NC1=CC=C(C=C1Cl)[N+]([O-])=O
Synonym niclosamide,5-chloro-n-2-chloro-4-nitrophenyl-2-hydroxybenzamide,niclocide,bayluscid,phenasal,tredemine,fenasal,yomesan,dichlosale,helmiantin
IUPAC Name 5-chloro-N-(2-chloro-4-nitrophenyl)-2-hydroxybenzamide
InChI Key RJMUSRYZPJIFPJ-UHFFFAOYSA-N
Molecular Formula C13H8Cl2N2O4
255

3-Fluorobenzyl alcohol, 98%

CAS: 456-47-3 Molecular Formula: C7H7FO Molecular Weight (g/mol): 126.13 MDL Number: MFCD00004631 InChI Key: QDHRSLFSDGCJFX-UHFFFAOYSA-N Synonym: 3-fluorobenzyl alcohol,3-fluorophenyl methanol,m-fluorobenzyl alcohol,benzenemethanol, 3-fluoro,3-fluorobenzylalcohol,3-fluorobenzylic alcohol,benzyl alcohol, m-fluoro,3-fluorophenyl methan-1-ol,3-florobenzyl alcohol,pubchem3486 PubChem CID: 68008 IUPAC Name: (3-fluorophenyl)methanol SMILES: C1=CC(=CC(=C1)F)CO

PubChem CID 68008
CAS 456-47-3
Molecular Weight (g/mol) 126.13
MDL Number MFCD00004631
SMILES C1=CC(=CC(=C1)F)CO
Synonym 3-fluorobenzyl alcohol,3-fluorophenyl methanol,m-fluorobenzyl alcohol,benzenemethanol, 3-fluoro,3-fluorobenzylalcohol,3-fluorobenzylic alcohol,benzyl alcohol, m-fluoro,3-fluorophenyl methan-1-ol,3-florobenzyl alcohol,pubchem3486
IUPAC Name (3-fluorophenyl)methanol
InChI Key QDHRSLFSDGCJFX-UHFFFAOYSA-N
Molecular Formula C7H7FO