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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 (44,067)
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1,336 – 1,350 of 119,425 results
1,336

Centrophenoxine hydrochloride, 98%

CAS: 3685-84-5 Molecular Formula: C12H17Cl2NO3 Molecular Weight (g/mol): 294.17 MDL Number: MFCD00012533 InChI Key: FIVHOHCAXWQPGC-UHFFFAOYSA-N Synonym: meclofenoxate hydrochloride,centrophenoxine hydrochloride,lucidril,cerutil,meclofenoxate hcl,atsefen,helfergin,marucotol,acefen,brenal PubChem CID: 19379 IUPAC Name: hydrogen 2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate chloride SMILES: [H+].[Cl-].CN(C)CCOC(=O)COC1=CC=C(Cl)C=C1

PubChem CID 19379
CAS 3685-84-5
Molecular Weight (g/mol) 294.17
MDL Number MFCD00012533
SMILES [H+].[Cl-].CN(C)CCOC(=O)COC1=CC=C(Cl)C=C1
Synonym meclofenoxate hydrochloride,centrophenoxine hydrochloride,lucidril,cerutil,meclofenoxate hcl,atsefen,helfergin,marucotol,acefen,brenal
IUPAC Name hydrogen 2-(dimethylamino)ethyl 2-(4-chlorophenoxy)acetate chloride
InChI Key FIVHOHCAXWQPGC-UHFFFAOYSA-N
Molecular Formula C12H17Cl2NO3
1,337

BML-259, 98%, Thermo Scientific Chemicals

CAS: 267654-00-2 Molecular Formula: C14H16N2OS Molecular Weight (g/mol): 260.355 MDL Number: MFCD09802287 InChI Key: IGRZXNLKVUEFDM-UHFFFAOYSA-N Synonym: n-5-isopropyl-thiazol-2-yl-2-phenyl-acetamide,n-5-isopropyl-1,3-thiazol-2-yl-2-phenylacetamide,biomolki_000077,biomolki2_000081,n-5-isopropyl-2-thiazolyl benzeneacetamide,n-5-isopropylthiazol-2-yl-2-phenylacetamide,2-phenyl-n-5-propan-2-yl-1,3-thiazol-2-yl acetamide,benzeneacetamide, n-5-1-methylethyl-2-thiazolyl PubChem CID: 16760027 IUPAC Name: 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide SMILES: CC(C)C1=CN=C(S1)NC(=O)CC2=CC=CC=C2

PubChem CID 16760027
CAS 267654-00-2
Molecular Weight (g/mol) 260.355
MDL Number MFCD09802287
SMILES CC(C)C1=CN=C(S1)NC(=O)CC2=CC=CC=C2
Synonym n-5-isopropyl-thiazol-2-yl-2-phenyl-acetamide,n-5-isopropyl-1,3-thiazol-2-yl-2-phenylacetamide,biomolki_000077,biomolki2_000081,n-5-isopropyl-2-thiazolyl benzeneacetamide,n-5-isopropylthiazol-2-yl-2-phenylacetamide,2-phenyl-n-5-propan-2-yl-1,3-thiazol-2-yl acetamide,benzeneacetamide, n-5-1-methylethyl-2-thiazolyl
IUPAC Name 2-phenyl-N-(5-propan-2-yl-1,3-thiazol-2-yl)acetamide
InChI Key IGRZXNLKVUEFDM-UHFFFAOYSA-N
Molecular Formula C14H16N2OS
1,338
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Methyl 2-amino-5-methoxybenzoate, 96%

CAS: 2475-80-1 Molecular Formula: C9H11NO3 Molecular Weight (g/mol): 181.19 MDL Number: MFCD09038482 InChI Key: MOVBJUGHBJJKOW-UHFFFAOYSA-N PubChem CID: 13052275 IUPAC Name: methyl 2-amino-5-methoxybenzoate SMILES: COC(=O)C1=C(N)C=CC(OC)=C1

PubChem CID 13052275
CAS 2475-80-1
Molecular Weight (g/mol) 181.19
MDL Number MFCD09038482
SMILES COC(=O)C1=C(N)C=CC(OC)=C1
IUPAC Name methyl 2-amino-5-methoxybenzoate
InChI Key MOVBJUGHBJJKOW-UHFFFAOYSA-N
Molecular Formula C9H11NO3
1,339
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N-Isopropyl-4-methylbenzenesulfonamide, 97%

CAS: 21230-07-9 Molecular Formula: C10H15NO2S Molecular Weight (g/mol): 213.295 MDL Number: MFCD00543042 InChI Key: NXUHAAIJVABUMJ-UHFFFAOYSA-N Synonym: n-isopropyl-4-methylbenzenesulfonamide,4-methyl-n-propan-2-yl benzene-1-sulfonamide,n-isopropyl-p-toluenesulfonamide,4-methyl-n-propan-2-yl benzenesulfonamide,methylethyl 4-methylphenyl sulfonyl amine PubChem CID: 4329528 IUPAC Name: 4-methyl-N-propan-2-ylbenzenesulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(C)C

PubChem CID 4329528
CAS 21230-07-9
Molecular Weight (g/mol) 213.295
MDL Number MFCD00543042
SMILES CC1=CC=C(C=C1)S(=O)(=O)NC(C)C
Synonym n-isopropyl-4-methylbenzenesulfonamide,4-methyl-n-propan-2-yl benzene-1-sulfonamide,n-isopropyl-p-toluenesulfonamide,4-methyl-n-propan-2-yl benzenesulfonamide,methylethyl 4-methylphenyl sulfonyl amine
IUPAC Name 4-methyl-N-propan-2-ylbenzenesulfonamide
InChI Key NXUHAAIJVABUMJ-UHFFFAOYSA-N
Molecular Formula C10H15NO2S
1,340
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3-(Benzyloxymethyl)cyclobutanone, 97%, Thermo Scientific Chemicals

CAS: 172324-67-3 Molecular Formula: C12H14O2 Molecular Weight (g/mol): 190.24 MDL Number: MFCD09055138 InChI Key: FHBBBGYOVFMVIB-UHFFFAOYSA-N PubChem CID: 11819850 IUPAC Name: 3-(phenylmethoxymethyl)cyclobutan-1-one SMILES: O=C1CC(COCC2=CC=CC=C2)C1

PubChem CID 11819850
CAS 172324-67-3
Molecular Weight (g/mol) 190.24
MDL Number MFCD09055138
SMILES O=C1CC(COCC2=CC=CC=C2)C1
IUPAC Name 3-(phenylmethoxymethyl)cyclobutan-1-one
InChI Key FHBBBGYOVFMVIB-UHFFFAOYSA-N
Molecular Formula C12H14O2
1,341
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2-Bromo-4-(trifluoromethyl)phenol, 98%

CAS: 81107-97-3 Molecular Formula: C7H4BrF3O Molecular Weight (g/mol): 241.007 MDL Number: MFCD06657954 InChI Key: DTEDKIRYMYDIGO-UHFFFAOYSA-N PubChem CID: 2761168 IUPAC Name: 2-bromo-4-(trifluoromethyl)phenol SMILES: C1=CC(=C(C=C1C(F)(F)F)Br)O

PubChem CID 2761168
CAS 81107-97-3
Molecular Weight (g/mol) 241.007
MDL Number MFCD06657954
SMILES C1=CC(=C(C=C1C(F)(F)F)Br)O
IUPAC Name 2-bromo-4-(trifluoromethyl)phenol
InChI Key DTEDKIRYMYDIGO-UHFFFAOYSA-N
Molecular Formula C7H4BrF3O
1,342
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2-[4-(Trifluoromethyl)phenyl]ethylamine, 98%

CAS: 775-00-8 Molecular Formula: C9H10F3N Molecular Weight (g/mol): 189.181 MDL Number: MFCD01529875 InChI Key: HMFOBPNVAAAACP-UHFFFAOYSA-N Synonym: 4-trifluoromethylphenethylamine,2-4-trifluoromethyl-phenyl-ethylamine,2-4-trifluoromethyl phenyl ethanamine,4-trifluoromethyl phenethylamine,2-4-trifluoromethyl-phenyl ethylamine,2-4-trifluoromethylphenyl ethylamine,2-4-trifluoromethyl phenyl ethan-1-amine,2-4-trifluoromethyl phenyl ethylamine,2-4-trifluoromethyl phenyl ethyl amine PubChem CID: 1988106 IUPAC Name: 2-[4-(trifluoromethyl)phenyl]ethanamine SMILES: C1=CC(=CC=C1CCN)C(F)(F)F

PubChem CID 1988106
CAS 775-00-8
Molecular Weight (g/mol) 189.181
MDL Number MFCD01529875
SMILES C1=CC(=CC=C1CCN)C(F)(F)F
Synonym 4-trifluoromethylphenethylamine,2-4-trifluoromethyl-phenyl-ethylamine,2-4-trifluoromethyl phenyl ethanamine,4-trifluoromethyl phenethylamine,2-4-trifluoromethyl-phenyl ethylamine,2-4-trifluoromethylphenyl ethylamine,2-4-trifluoromethyl phenyl ethan-1-amine,2-4-trifluoromethyl phenyl ethylamine,2-4-trifluoromethyl phenyl ethyl amine
IUPAC Name 2-[4-(trifluoromethyl)phenyl]ethanamine
InChI Key HMFOBPNVAAAACP-UHFFFAOYSA-N
Molecular Formula C9H10F3N
1,343
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3-Nitrobenzotrifluoride, 97%

CAS: 98-46-4 Molecular Formula: C7H4F3NO2 Molecular Weight (g/mol): 191.109 MDL Number: MFCD00007260 InChI Key: WHNAMGUAXHGCHH-UHFFFAOYSA-N Synonym: 3-nitrobenzotrifluoride,1-nitro-3-trifluoromethyl benzene,m-nitrobenzotrifluoride,3-trifluoromethyl nitrobenzene,m-nitrotrifluorotoluene,benzene, 1-nitro-3-trifluoromethyl,1,3-nitrobenzotrifluoride,m-nitrotrifluortoluol,usaf ma-5,3-trifluoromethylnitrobenzene PubChem CID: 7386 IUPAC Name: 1-nitro-3-(trifluoromethyl)benzene SMILES: C1=CC(=CC(=C1)[N+](=O)[O-])C(F)(F)F

PubChem CID 7386
CAS 98-46-4
Molecular Weight (g/mol) 191.109
MDL Number MFCD00007260
SMILES C1=CC(=CC(=C1)[N+](=O)[O-])C(F)(F)F
Synonym 3-nitrobenzotrifluoride,1-nitro-3-trifluoromethyl benzene,m-nitrobenzotrifluoride,3-trifluoromethyl nitrobenzene,m-nitrotrifluorotoluene,benzene, 1-nitro-3-trifluoromethyl,1,3-nitrobenzotrifluoride,m-nitrotrifluortoluol,usaf ma-5,3-trifluoromethylnitrobenzene
IUPAC Name 1-nitro-3-(trifluoromethyl)benzene
InChI Key WHNAMGUAXHGCHH-UHFFFAOYSA-N
Molecular Formula C7H4F3NO2
1,344
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3,4-Dichlorobenzyl bromide, 98%

CAS: 18880-04-1 Molecular Formula: C7H5BrCl2 Molecular Weight (g/mol): 239.921 MDL Number: MFCD00041363 InChI Key: XLWSBDFQAJXCQX-UHFFFAOYSA-N Synonym: 3,4-dichlorobenzyl bromide,4-bromomethyl-1,2-dichlorobenzene,benzene, 4-bromomethyl-1,2-dichloro,3,4-dichlorobenzylbromide,alpha-bromo-3,4-dichlorotoluene,acmc-209erq,3,4 dichlorobenzyl bromide,3,4-dichloro-benzyl bromide,ksc493a6b,timtec-bb sbb005763 PubChem CID: 639726 IUPAC Name: 4-(bromomethyl)-1,2-dichlorobenzene SMILES: C1=CC(=C(C=C1CBr)Cl)Cl

PubChem CID 639726
CAS 18880-04-1
Molecular Weight (g/mol) 239.921
MDL Number MFCD00041363
SMILES C1=CC(=C(C=C1CBr)Cl)Cl
Synonym 3,4-dichlorobenzyl bromide,4-bromomethyl-1,2-dichlorobenzene,benzene, 4-bromomethyl-1,2-dichloro,3,4-dichlorobenzylbromide,alpha-bromo-3,4-dichlorotoluene,acmc-209erq,3,4 dichlorobenzyl bromide,3,4-dichloro-benzyl bromide,ksc493a6b,timtec-bb sbb005763
IUPAC Name 4-(bromomethyl)-1,2-dichlorobenzene
InChI Key XLWSBDFQAJXCQX-UHFFFAOYSA-N
Molecular Formula C7H5BrCl2
1,345
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N-Phenylthiourea, 97%

CAS: 103-85-5 Molecular Formula: C7H8N2S Molecular Weight (g/mol): 152.22 MDL Number: MFCD00004933 InChI Key: FULZLIGZKMKICU-UHFFFAOYSA-N Synonym: n-phenylthiourea,1-phenylthiourea,1-phenyl-2-thiourea,phenylthiocarbamide,thiourea, phenyl,phenyl-2-thiourea,fenylthiomocovina,urea, 1-phenyl-2-thio,rcra waste number p093,phenyl-thiourea PubChem CID: 676454 ChEBI: CHEBI:46261 IUPAC Name: phenylthiourea SMILES: NC(=S)NC1=CC=CC=C1

PubChem CID 676454
CAS 103-85-5
Molecular Weight (g/mol) 152.22
ChEBI CHEBI:46261
MDL Number MFCD00004933
SMILES NC(=S)NC1=CC=CC=C1
Synonym n-phenylthiourea,1-phenylthiourea,1-phenyl-2-thiourea,phenylthiocarbamide,thiourea, phenyl,phenyl-2-thiourea,fenylthiomocovina,urea, 1-phenyl-2-thio,rcra waste number p093,phenyl-thiourea
IUPAC Name phenylthiourea
InChI Key FULZLIGZKMKICU-UHFFFAOYSA-N
Molecular Formula C7H8N2S
1,346
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2,4,6-Trimethoxytoluene, 97%

CAS: 14107-97-2 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.219 MDL Number: MFCD00008375 InChI Key: TZPKFPYZCMHDHL-UHFFFAOYSA-N PubChem CID: 84201 IUPAC Name: 1,3,5-trimethoxy-2-methylbenzene SMILES: CC1=C(C=C(C=C1OC)OC)OC

PubChem CID 84201
CAS 14107-97-2
Molecular Weight (g/mol) 182.219
MDL Number MFCD00008375
SMILES CC1=C(C=C(C=C1OC)OC)OC
IUPAC Name 1,3,5-trimethoxy-2-methylbenzene
InChI Key TZPKFPYZCMHDHL-UHFFFAOYSA-N
Molecular Formula C10H14O3
1,347
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3-Fluorophenylhydrazine hydrochloride, 98%

CAS: 2924-16-5 Molecular Formula: C6H8ClFN2 Molecular Weight (g/mol): 162.592 MDL Number: MFCD00012934 InChI Key: SKVGLOFWEJFQKU-UHFFFAOYSA-N Synonym: 3-fluorophenylhydrazine hydrochloride,3-fluorophenyl hydrazine hydrochloride,3-fluorophenylhydrazine hcl,3-fluorophenyl hydrazine hcl,m-fluorophenylhydrazine hydrochloride,hydrazine, 3-fluorophenyl-, monohydrochloride,1-3-fluorophenyl hydrazine hydrochloride,3-fluoro-phenyl-hydrazine,pubchem3341,acmc-20a0dq PubChem CID: 2723914 IUPAC Name: (3-fluorophenyl)hydrazine;hydrochloride SMILES: C1=CC(=CC(=C1)F)NN.Cl

PubChem CID 2723914
CAS 2924-16-5
Molecular Weight (g/mol) 162.592
MDL Number MFCD00012934
SMILES C1=CC(=CC(=C1)F)NN.Cl
Synonym 3-fluorophenylhydrazine hydrochloride,3-fluorophenyl hydrazine hydrochloride,3-fluorophenylhydrazine hcl,3-fluorophenyl hydrazine hcl,m-fluorophenylhydrazine hydrochloride,hydrazine, 3-fluorophenyl-, monohydrochloride,1-3-fluorophenyl hydrazine hydrochloride,3-fluoro-phenyl-hydrazine,pubchem3341,acmc-20a0dq
IUPAC Name (3-fluorophenyl)hydrazine;hydrochloride
InChI Key SKVGLOFWEJFQKU-UHFFFAOYSA-N
Molecular Formula C6H8ClFN2
1,348
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4-Methoxybenzenesulfonamide, 98%

CAS: 1129-26-6 Molecular Formula: C7H9NO3S Molecular Weight (g/mol): 187.213 MDL Number: MFCD00025392 InChI Key: MSFQEZBRFPAFEX-UHFFFAOYSA-N Synonym: 4-methoxybenzenesulphonamide,p-methoxybenzenesulfonamide,4-methoxybenzene-1-sulfonamide,benzenesulfonamide, 4-methoxy,4-methoxy-benzenesulfonamide,benzenesulfonamide, p-methoxy,benzenesulfonamide, p-methoxy-6ci,7ci,8ci,3lka,p-anisolesulfonamide,acmc-1bvgf PubChem CID: 70789 IUPAC Name: 4-methoxybenzenesulfonamide SMILES: COC1=CC=C(C=C1)S(=O)(=O)N

PubChem CID 70789
CAS 1129-26-6
Molecular Weight (g/mol) 187.213
MDL Number MFCD00025392
SMILES COC1=CC=C(C=C1)S(=O)(=O)N
Synonym 4-methoxybenzenesulphonamide,p-methoxybenzenesulfonamide,4-methoxybenzene-1-sulfonamide,benzenesulfonamide, 4-methoxy,4-methoxy-benzenesulfonamide,benzenesulfonamide, p-methoxy,benzenesulfonamide, p-methoxy-6ci,7ci,8ci,3lka,p-anisolesulfonamide,acmc-1bvgf
IUPAC Name 4-methoxybenzenesulfonamide
InChI Key MSFQEZBRFPAFEX-UHFFFAOYSA-N
Molecular Formula C7H9NO3S
1,349
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4-Chloro-2-(trifluoromethyl)phenyl isocyanate, 97%

CAS: 16588-69-5 Molecular Formula: C8H3ClF3NO Molecular Weight (g/mol): 221.56 MDL Number: MFCD00013873 InChI Key: SBDPJLJFODHSFF-UHFFFAOYSA-N Synonym: 4-chloro-2-trifluoromethyl phenyl isocyanate,4-chloro-1-isocyanato-2-trifluoromethyl benzene,4-chloro-2-trifluoromethyl phenylisocyanate,5-chloro-2-isocyanatobenzotrifluoride,timtec-bb sbb006655,4-chloro-2-trifluoromethyl benzenisocyanate,pubchem4450,acmc-1c7bp,4-chloro-2-trifluoromethylphenyl isocyanate,4-chloro-2-trifluoromethyl-isocyanatobenzene PubChem CID: 2733264 IUPAC Name: 4-chloro-1-isocyanato-2-(trifluoromethyl)benzene SMILES: FC(F)(F)C1=C(C=CC(Cl)=C1)N=C=O

PubChem CID 2733264
CAS 16588-69-5
Molecular Weight (g/mol) 221.56
MDL Number MFCD00013873
SMILES FC(F)(F)C1=C(C=CC(Cl)=C1)N=C=O
Synonym 4-chloro-2-trifluoromethyl phenyl isocyanate,4-chloro-1-isocyanato-2-trifluoromethyl benzene,4-chloro-2-trifluoromethyl phenylisocyanate,5-chloro-2-isocyanatobenzotrifluoride,timtec-bb sbb006655,4-chloro-2-trifluoromethyl benzenisocyanate,pubchem4450,acmc-1c7bp,4-chloro-2-trifluoromethylphenyl isocyanate,4-chloro-2-trifluoromethyl-isocyanatobenzene
IUPAC Name 4-chloro-1-isocyanato-2-(trifluoromethyl)benzene
InChI Key SBDPJLJFODHSFF-UHFFFAOYSA-N
Molecular Formula C8H3ClF3NO
1,350
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(S)-(+)-2-Phenylbutyric acid, 99%

CAS: 4286-15-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00063164 InChI Key: OFJWFSNDPCAWDK-VIFPVBQESA-N Synonym: s-+-2-phenylbutyric acid,s-2-phenylbutanoic acid,2s-2-phenylbutanoic acid,s-2-phenylbutyric acid,pubchem9874,2-phenylbutyric acid, s,s--2-phenyl-mutyric acid,s-+-2-phenylbutanoic acid,s-+-2-phenyl-mutyric acid PubChem CID: 785329 IUPAC Name: (2S)-2-phenylbutanoic acid SMILES: CCC(C1=CC=CC=C1)C(=O)O

PubChem CID 785329
CAS 4286-15-1
Molecular Weight (g/mol) 164.204
MDL Number MFCD00063164
SMILES CCC(C1=CC=CC=C1)C(=O)O
Synonym s-+-2-phenylbutyric acid,s-2-phenylbutanoic acid,2s-2-phenylbutanoic acid,s-2-phenylbutyric acid,pubchem9874,2-phenylbutyric acid, s,s--2-phenyl-mutyric acid,s-+-2-phenylbutanoic acid,s-+-2-phenyl-mutyric acid
IUPAC Name (2S)-2-phenylbutanoic acid
InChI Key OFJWFSNDPCAWDK-VIFPVBQESA-N
Molecular Formula C10H12O2