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.

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5,326 – 5,340 of 57,280 results

5,326

Diphenyl Sulfone 99.0+%, TCI America™

CAS: 127-63-9 Molecular Formula: C12H10O2S Molecular Weight (g/mol): 218.27 MDL Number: MFCD00007548 InChI Key: KZTYYGOKRVBIMI-UHFFFAOYSA-N Synonym: diphenyl sulfone,phenyl sulfone,sulfonyldibenzene,diphenylsulfone,sulfobenzide,diphenyl sulphone,benzene, 1,1'-sulfonylbis,sulfone, diphenyl,1,1'-sulfonyldibenzene,phenyl sulphone PubChem CID: 31386 ChEBI: CHEBI:78360 IUPAC Name: (benzenesulfonyl)benzene SMILES: O=S(=O)(C1=CC=CC=C1)C1=CC=CC=C1

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PubChem CID	31386
CAS	127-63-9
Molecular Weight (g/mol)	218.27
ChEBI	CHEBI:78360
MDL Number	MFCD00007548
SMILES	O=S(=O)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym	diphenyl sulfone,phenyl sulfone,sulfonyldibenzene,diphenylsulfone,sulfobenzide,diphenyl sulphone,benzene, 1,1'-sulfonylbis,sulfone, diphenyl,1,1'-sulfonyldibenzene,phenyl sulphone
IUPAC Name	(benzenesulfonyl)benzene
InChI Key	KZTYYGOKRVBIMI-UHFFFAOYSA-N
Molecular Formula	C12H10O2S

5,327

4-Benzyloxyphenyl 4-Hydroxyphenyl Sulfone 98.0+%, TCI America™

CAS: 63134-33-8 Molecular Formula: C19H16O4S Molecular Weight (g/mol): 340.393 InChI Key: UWPJWCBDMZHMTN-UHFFFAOYSA-N PubChem CID: 113063 IUPAC Name: 4-(4-phenylmethoxyphenyl)sulfonylphenol SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)O

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Specifications

PubChem CID	113063
CAS	63134-33-8
Molecular Weight (g/mol)	340.393
SMILES	C1=CC=C(C=C1)COC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)O
IUPAC Name	4-(4-phenylmethoxyphenyl)sulfonylphenol
InChI Key	UWPJWCBDMZHMTN-UHFFFAOYSA-N
Molecular Formula	C19H16O4S

5,328

4-Chlorophenyl Phenyl Sulfone 96.0+%, TCI America™

CAS: 80-00-2 Molecular Formula: C12H9ClO2S Molecular Weight (g/mol): 252.712 MDL Number: MFCD00007549 InChI Key: OFCFYWOKHPOXKF-UHFFFAOYSA-N Synonym: 4-Chlorodiphenyl Sulfone, 1-Chloro-4-(phenylsulfonyl)benzene, Sulferone PubChem CID: 6621 IUPAC Name: 1-(benzenesulfonyl)-4-chlorobenzene SMILES: C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)Cl

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Specifications

PubChem CID	6621
CAS	80-00-2
Molecular Weight (g/mol)	252.712
MDL Number	MFCD00007549
SMILES	C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)Cl
Synonym	4-Chlorodiphenyl Sulfone, 1-Chloro-4-(phenylsulfonyl)benzene, Sulferone
IUPAC Name	1-(benzenesulfonyl)-4-chlorobenzene
InChI Key	OFCFYWOKHPOXKF-UHFFFAOYSA-N
Molecular Formula	C12H9ClO2S

5,329

Phenyl Vinyl Sulfone 98.0+%, TCI America™

CAS: 5535-48-8 Molecular Formula: C8H8O2S Molecular Weight (g/mol): 168.21 MDL Number: MFCD00007554 InChI Key: UJTPZISIAWDGFF-UHFFFAOYSA-N Synonym: phenyl vinyl sulfone,vinylsulfonyl benzene,ethenesulfonyl benzene,benzene, ethenylsulfonyl,sulfone, phenyl vinyl,vinylsulfonylbenzene,phenyl vinyl sulphone,ethenylsulfonyl benzene,ethenesulfonyl-benzene,phenyl-vinylsulfon PubChem CID: 79664 IUPAC Name: (ethenesulfonyl)benzene SMILES: C=CS(=O)(=O)C1=CC=CC=C1

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Specifications

PubChem CID	79664
CAS	5535-48-8
Molecular Weight (g/mol)	168.21
MDL Number	MFCD00007554
SMILES	C=CS(=O)(=O)C1=CC=CC=C1
Synonym	phenyl vinyl sulfone,vinylsulfonyl benzene,ethenesulfonyl benzene,benzene, ethenylsulfonyl,sulfone, phenyl vinyl,vinylsulfonylbenzene,phenyl vinyl sulphone,ethenylsulfonyl benzene,ethenesulfonyl-benzene,phenyl-vinylsulfon
IUPAC Name	(ethenesulfonyl)benzene
InChI Key	UJTPZISIAWDGFF-UHFFFAOYSA-N
Molecular Formula	C8H8O2S

5,330

2-(Isopropylsulfonyl)aniline 98.0+%, TCI America™

CAS: 76697-50-2 Molecular Formula: C9H13NO2S Molecular Weight (g/mol): 199.27 MDL Number: MFCD08445603 InChI Key: GMLAMRMKROYXNZ-UHFFFAOYSA-N Synonym: 2-Aminophenyl Isopropyl Sulfone PubChem CID: 12646366 IUPAC Name: 2-(propane-2-sulfonyl)aniline SMILES: CC(C)S(=O)(=O)C1=CC=CC=C1N

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Specifications

PubChem CID	12646366
CAS	76697-50-2
Molecular Weight (g/mol)	199.27
MDL Number	MFCD08445603
SMILES	CC(C)S(=O)(=O)C1=CC=CC=C1N
Synonym	2-Aminophenyl Isopropyl Sulfone
IUPAC Name	2-(propane-2-sulfonyl)aniline
InChI Key	GMLAMRMKROYXNZ-UHFFFAOYSA-N
Molecular Formula	C9H13NO2S

5,331

Methyl 2-Methoxy-5-(methylsulfonyl)benzoate 98.0+%, TCI America™

CAS: 63484-12-8 Molecular Formula: C10H12O5S Molecular Weight (g/mol): 244.261 MDL Number: MFCD01317545 InChI Key: DSRPTFIZJVCPPS-UHFFFAOYSA-N Synonym: 2-Methoxy-5-(methylsulfonyl)benzoic Acid Methyl Ester PubChem CID: 6454622 IUPAC Name: methyl 2-methoxy-5-methylsulfonylbenzoate SMILES: COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OC

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Specifications

PubChem CID	6454622
CAS	63484-12-8
Molecular Weight (g/mol)	244.261
MDL Number	MFCD01317545
SMILES	COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)OC
Synonym	2-Methoxy-5-(methylsulfonyl)benzoic Acid Methyl Ester
IUPAC Name	methyl 2-methoxy-5-methylsulfonylbenzoate
InChI Key	DSRPTFIZJVCPPS-UHFFFAOYSA-N
Molecular Formula	C10H12O5S

5,332

Fluoromethyl Phenyl Sulfone 98.0+%, TCI America™

CAS: 20808-12-2 Molecular Formula: C7H7FO2S Molecular Weight (g/mol): 174.189 MDL Number: MFCD00191650 InChI Key: DENHPZASLKBBHA-UHFFFAOYSA-N Synonym: Fluoromethylsulfonylbenzene PubChem CID: 2759036 IUPAC Name: fluoromethylsulfonylbenzene SMILES: C1=CC=C(C=C1)S(=O)(=O)CF

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Specifications

PubChem CID	2759036
CAS	20808-12-2
Molecular Weight (g/mol)	174.189
MDL Number	MFCD00191650
SMILES	C1=CC=C(C=C1)S(=O)(=O)CF
Synonym	Fluoromethylsulfonylbenzene
IUPAC Name	fluoromethylsulfonylbenzene
InChI Key	DENHPZASLKBBHA-UHFFFAOYSA-N
Molecular Formula	C7H7FO2S

5,333

4-(Methylsulfonyl)phenylacetic Acid 98.0+%, TCI America™

CAS: 90536-66-6 Molecular Formula: C9H10O4S Molecular Weight (g/mol): 214.235 MDL Number: MFCD00216495 InChI Key: HGGWOSYNRVOQJH-UHFFFAOYSA-N Synonym: 4-methylsulfonyl phenylacetic acid,4-methylsulphonylphenylacetic acid,2-4-methylsulfonyl phenyl acetic acid,4-mesylphenylacetic acid,4-methanesulfonylphenyl acetic acid,4-methylsulfonyl phenyl acetic acid,4-methanesulfonyl phenylacetic acid,2-4-methanesulfonylphenyl acetic acid,4-methylsulfonylphenylacetic acid PubChem CID: 572345 IUPAC Name: 2-(4-methylsulfonylphenyl)acetic acid SMILES: CS(=O)(=O)C1=CC=C(C=C1)CC(=O)O

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Specifications

PubChem CID	572345
CAS	90536-66-6
Molecular Weight (g/mol)	214.235
MDL Number	MFCD00216495
SMILES	CS(=O)(=O)C1=CC=C(C=C1)CC(=O)O
Synonym	4-methylsulfonyl phenylacetic acid,4-methylsulphonylphenylacetic acid,2-4-methylsulfonyl phenyl acetic acid,4-mesylphenylacetic acid,4-methanesulfonylphenyl acetic acid,4-methylsulfonyl phenyl acetic acid,4-methanesulfonyl phenylacetic acid,2-4-methanesulfonylphenyl acetic acid,4-methylsulfonylphenylacetic acid
IUPAC Name	2-(4-methylsulfonylphenyl)acetic acid
InChI Key	HGGWOSYNRVOQJH-UHFFFAOYSA-N
Molecular Formula	C9H10O4S

5,334

3-Bromophenyl Methyl Sulfone 98.0+%, TCI America™

CAS: 34896-80-5 Molecular Formula: C7H7BrO2S Molecular Weight (g/mol): 235.10 MDL Number: MFCD03095326 InChI Key: WBOMXUMQOVQNKT-UHFFFAOYSA-N PubChem CID: 2757146 IUPAC Name: 1-bromo-3-methanesulfonylbenzene SMILES: CS(=O)(=O)C1=CC=CC(Br)=C1

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Specifications

PubChem CID	2757146
CAS	34896-80-5
Molecular Weight (g/mol)	235.10
MDL Number	MFCD03095326
SMILES	CS(=O)(=O)C1=CC=CC(Br)=C1
IUPAC Name	1-bromo-3-methanesulfonylbenzene
InChI Key	WBOMXUMQOVQNKT-UHFFFAOYSA-N
Molecular Formula	C7H7BrO2S

5,335

N-[4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide 98.0+%, TCI America™

CAS: 616880-14-9 Molecular Formula: C13H20BNO4S Molecular Weight (g/mol): 297.176 MDL Number: MFCD05663876 InChI Key: NPSPNWPZDXQYAC-UHFFFAOYSA-N Synonym: n-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanesulfonamide,4-methanesulfonylamino phenylboronic acid pinacol ester,4-methanesulfonylaminophenylboronic acid, pinacol ester,4-methanesulfonylaminophenylboronic acid pinacol ester,n-4-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanesulfonamide,amtb416,4-methanesulfonylamino phenyl boronic acid pinacol ester,4-methanesulfonamido phenylboronic acid pinacol ester PubChem CID: 16217653 IUPAC Name: N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)NS(=O)(=O)C

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Specifications

PubChem CID	16217653
CAS	616880-14-9
Molecular Weight (g/mol)	297.176
MDL Number	MFCD05663876
SMILES	B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)NS(=O)(=O)C
Synonym	n-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanesulfonamide,4-methanesulfonylamino phenylboronic acid pinacol ester,4-methanesulfonylaminophenylboronic acid, pinacol ester,4-methanesulfonylaminophenylboronic acid pinacol ester,n-4-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl methanesulfonamide,amtb416,4-methanesulfonylamino phenyl boronic acid pinacol ester,4-methanesulfonamido phenylboronic acid pinacol ester
IUPAC Name	N-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanesulfonamide
InChI Key	NPSPNWPZDXQYAC-UHFFFAOYSA-N
Molecular Formula	C13H20BNO4S

5,336

2,2-Diphenylpropionitrile 98.0+%, TCI America™

CAS: 5558-67-8 Molecular Formula: C15H13N Molecular Weight (g/mol): 207.276 MDL Number: MFCD00001846 InChI Key: DPVHBXFSKLKYIQ-UHFFFAOYSA-N Synonym: 2,2-diphenylpropionitrile,1,1-diphenylethyl cyanide,2,2-diphenylpropiononitrile,2,2-diphenyl propionitrile,.alpha.,.alpha.-diphenylpropionitrile,pubchem12547,acmc-209lnw,2,2-diphenylpropanitrile,2,2-diphenyl-propionitrile,2, 2-diphenyl propionitrile PubChem CID: 79677 IUPAC Name: 2,2-diphenylpropanenitrile SMILES: CC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2

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Specifications

PubChem CID	79677
CAS	5558-67-8
Molecular Weight (g/mol)	207.276
MDL Number	MFCD00001846
SMILES	CC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2
Synonym	2,2-diphenylpropionitrile,1,1-diphenylethyl cyanide,2,2-diphenylpropiononitrile,2,2-diphenyl propionitrile,.alpha.,.alpha.-diphenylpropionitrile,pubchem12547,acmc-209lnw,2,2-diphenylpropanitrile,2,2-diphenyl-propionitrile,2, 2-diphenyl propionitrile
IUPAC Name	2,2-diphenylpropanenitrile
InChI Key	DPVHBXFSKLKYIQ-UHFFFAOYSA-N
Molecular Formula	C15H13N

5,337

4,4'-Dimethoxybenzophenone 99.0+%, TCI America™

CAS: 90-96-0 Molecular Formula: C15H14O3 Molecular Weight (g/mol): 242.27 MDL Number: MFCD00008404 InChI Key: RFVHVYKVRGKLNK-UHFFFAOYSA-N Synonym: 4,4'-dimethoxybenzophenone,bis 4-methoxyphenyl methanone,methanone, bis 4-methoxyphenyl,p,p'-dimethoxybenzophenone,dmbp,bis p-anisyl ketone,bis 4-anisyl ketone,bis p-methoxy benzophenone,benzophenone, 4,4'-dimethoxy,1,1-di p-methoxyphenyl-ketone PubChem CID: 7032 IUPAC Name: bis(4-methoxyphenyl)methanone SMILES: COC1=CC=C(C=C1)C(=O)C1=CC=C(OC)C=C1

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Specifications

PubChem CID	7032
CAS	90-96-0
Molecular Weight (g/mol)	242.27
MDL Number	MFCD00008404
SMILES	COC1=CC=C(C=C1)C(=O)C1=CC=C(OC)C=C1
Synonym	4,4'-dimethoxybenzophenone,bis 4-methoxyphenyl methanone,methanone, bis 4-methoxyphenyl,p,p'-dimethoxybenzophenone,dmbp,bis p-anisyl ketone,bis 4-anisyl ketone,bis p-methoxy benzophenone,benzophenone, 4,4'-dimethoxy,1,1-di p-methoxyphenyl-ketone
IUPAC Name	bis(4-methoxyphenyl)methanone
InChI Key	RFVHVYKVRGKLNK-UHFFFAOYSA-N
Molecular Formula	C15H14O3

5,338

4-Nitrobenzophenone 99.0+%, TCI America™

CAS: 1144-74-7 Molecular Formula: C13H9NO3 Molecular Weight (g/mol): 227.22 MDL Number: MFCD00007354 InChI Key: ZYMCBJWUWHHVRX-UHFFFAOYSA-N Synonym: 4-nitrobenzophenone,p-nitrobenzophenone,4-nitrophenyl phenyl methanone,benzophenone, 4-nitro,methanone, 4-nitrophenyl phenyl,4-nitrophenyl phenyl ketone,4-nitrophenyl-phenylmethanone,4-nitrophenyl-phenyl-methanone,4-nitro-benzophenone PubChem CID: 70839 IUPAC Name: (4-nitrophenyl)(phenyl)methanone SMILES: [O-][N+](=O)C1=CC=C(C=C1)C(=O)C1=CC=CC=C1

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Specifications

PubChem CID	70839
CAS	1144-74-7
Molecular Weight (g/mol)	227.22
MDL Number	MFCD00007354
SMILES	[O-][N+](=O)C1=CC=C(C=C1)C(=O)C1=CC=CC=C1
Synonym	4-nitrobenzophenone,p-nitrobenzophenone,4-nitrophenyl phenyl methanone,benzophenone, 4-nitro,methanone, 4-nitrophenyl phenyl,4-nitrophenyl phenyl ketone,4-nitrophenyl-phenylmethanone,4-nitrophenyl-phenyl-methanone,4-nitro-benzophenone
IUPAC Name	(4-nitrophenyl)(phenyl)methanone
InChI Key	ZYMCBJWUWHHVRX-UHFFFAOYSA-N
Molecular Formula	C13H9NO3

5,339

4,4'-Bis(dimethylamino)benzophenone 98.0+%, TCI America™

CAS: 90-94-8 Molecular Formula: C17H20N2O Molecular Weight (g/mol): 268.36 MDL Number: MFCD00008312 InChI Key: VVBLNCFGVYUYGU-UHFFFAOYSA-N Synonym: michler's ketone,4,4'-bis dimethylamino benzophenone,michler ketone,bis 4-dimethylamino phenyl methanone,p,p'-michler's ketone,michlers ketone,methanone, bis 4-dimethylamino phenyl,tetramethyldiaminobenzophenone,p,p'-bis dimethylamino benzophenone PubChem CID: 7031 ChEBI: CHEBI:82347 IUPAC Name: 4-[4-(dimethylamino)benzoyl]-N,N-dimethylaniline SMILES: CN(C)C1=CC=C(C=C1)C(=O)C1=CC=C(C=C1)N(C)C

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Specifications

PubChem CID	7031
CAS	90-94-8
Molecular Weight (g/mol)	268.36
ChEBI	CHEBI:82347
MDL Number	MFCD00008312
SMILES	CN(C)C1=CC=C(C=C1)C(=O)C1=CC=C(C=C1)N(C)C
Synonym	michler's ketone,4,4'-bis dimethylamino benzophenone,michler ketone,bis 4-dimethylamino phenyl methanone,p,p'-michler's ketone,michlers ketone,methanone, bis 4-dimethylamino phenyl,tetramethyldiaminobenzophenone,p,p'-bis dimethylamino benzophenone
IUPAC Name	4-[4-(dimethylamino)benzoyl]-N,N-dimethylaniline
InChI Key	VVBLNCFGVYUYGU-UHFFFAOYSA-N
Molecular Formula	C17H20N2O

5,340

2,4,5-Trimethylbenzophenone 95.0+%, TCI America™

CAS: 52890-52-5 Molecular Formula: C16H16O Molecular Weight (g/mol): 224.303 InChI Key: FTPZYWUJDVZEIE-UHFFFAOYSA-N PubChem CID: 14907151 IUPAC Name: phenyl-(2,4,5-trimethylphenyl)methanone SMILES: CC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)C)C

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Specifications

PubChem CID	14907151
CAS	52890-52-5
Molecular Weight (g/mol)	224.303
SMILES	CC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)C)C
IUPAC Name	phenyl-(2,4,5-trimethylphenyl)methanone
InChI Key	FTPZYWUJDVZEIE-UHFFFAOYSA-N
Molecular Formula	C16H16O

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Benzene and substituted derivatives

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