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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5,656 – 5,670 of 77,613 results

5,656

1,3-Dibromo-5-iodobenzene 98.0+%, TCI America™

CAS: 19752-57-9 Molecular Formula: C6H3Br2I Molecular Weight (g/mol): 361.80 MDL Number: MFCD07778996 InChI Key: KARUMYWDGQTPFL-UHFFFAOYSA-N PubChem CID: 11068437 IUPAC Name: 1,3-dibromo-5-iodobenzene SMILES: BrC1=CC(I)=CC(Br)=C1

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Specifications

PubChem CID	11068437
CAS	19752-57-9
Molecular Weight (g/mol)	361.80
MDL Number	MFCD07778996
SMILES	BrC1=CC(I)=CC(Br)=C1
IUPAC Name	1,3-dibromo-5-iodobenzene
InChI Key	KARUMYWDGQTPFL-UHFFFAOYSA-N
Molecular Formula	C6H3Br2I

5,657

N-Succinimidyl 3-Maleimidobenzoate 98.0+%, TCI America™

CAS: 58626-38-3 Molecular Formula: C15H10N2O6 Molecular Weight (g/mol): 314.253 MDL Number: MFCD00005514 InChI Key: LLXVXPPXELIDGQ-UHFFFAOYSA-N Synonym: 3-maleimidobenzoic acid n-hydroxysuccinimide ester,n-succinimidyl 3-maleimidobenzoate,3-maleimidobenzoyl n-hydroxysuccinimide,1-3-2,5-dioxopyrrolidinyl oxy carbonyl phenyl-1h-pyrrole-2,5-dione,m-maleimidobenzoyl-n-hydroxysuccinimide ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxopyrrol-1-yl benzoate,3-n-maleimidobenzoic acid n-succinimidyl ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl benzoate,ambotzpeg2090 PubChem CID: 93861 IUPAC Name: (2,5-dioxopyrrolidin-1-yl) 3-(2,5-dioxopyrrol-1-yl)benzoate SMILES: C1CC(=O)N(C1=O)OC(=O)C2=CC(=CC=C2)N3C(=O)C=CC3=O

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Specifications

PubChem CID	93861
CAS	58626-38-3
Molecular Weight (g/mol)	314.253
MDL Number	MFCD00005514
SMILES	C1CC(=O)N(C1=O)OC(=O)C2=CC(=CC=C2)N3C(=O)C=CC3=O
Synonym	3-maleimidobenzoic acid n-hydroxysuccinimide ester,n-succinimidyl 3-maleimidobenzoate,3-maleimidobenzoyl n-hydroxysuccinimide,1-3-2,5-dioxopyrrolidinyl oxy carbonyl phenyl-1h-pyrrole-2,5-dione,m-maleimidobenzoyl-n-hydroxysuccinimide ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxopyrrol-1-yl benzoate,3-n-maleimidobenzoic acid n-succinimidyl ester,2,5-dioxopyrrolidin-1-yl 3-2,5-dioxo-2,5-dihydro-1h-pyrrol-1-yl benzoate,ambotzpeg2090
IUPAC Name	(2,5-dioxopyrrolidin-1-yl) 3-(2,5-dioxopyrrol-1-yl)benzoate
InChI Key	LLXVXPPXELIDGQ-UHFFFAOYSA-N
Molecular Formula	C15H10N2O6

5,658

4,4'-Dichlorobenzhydrol 98.0+%, TCI America™

CAS: 90-97-1 Molecular Formula: C13H10Cl2O Molecular Weight (g/mol): 253.12 MDL Number: MFCD00000629 InChI Key: PHUYGURFBULKPA-UHFFFAOYSA-N Synonym: 4,4'-dichlorobenzhydrol,bis 4-chlorophenyl methanol,p,p'-dichlorobenzhydrol,unii-cr5kh591g4,benzenemethanol, 4-chloro-.alpha.-4-chlorophenyl,bis 4-chlorophenyl methan-1-ol,4,4'-dichloro-a-phenylbenzylic alcohol,bis 4-chlorphenyl methanol,4,4'-dichloro-alpha-phenylbenzylic alcohol,4,4-dicholobenzhydrol PubChem CID: 7033 IUPAC Name: bis(4-chlorophenyl)methanol SMILES: OC(C1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1

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Specifications

PubChem CID	7033
CAS	90-97-1
Molecular Weight (g/mol)	253.12
MDL Number	MFCD00000629
SMILES	OC(C1=CC=C(Cl)C=C1)C1=CC=C(Cl)C=C1
Synonym	4,4'-dichlorobenzhydrol,bis 4-chlorophenyl methanol,p,p'-dichlorobenzhydrol,unii-cr5kh591g4,benzenemethanol, 4-chloro-.alpha.-4-chlorophenyl,bis 4-chlorophenyl methan-1-ol,4,4'-dichloro-a-phenylbenzylic alcohol,bis 4-chlorphenyl methanol,4,4'-dichloro-alpha-phenylbenzylic alcohol,4,4-dicholobenzhydrol
IUPAC Name	bis(4-chlorophenyl)methanol
InChI Key	PHUYGURFBULKPA-UHFFFAOYSA-N
Molecular Formula	C13H10Cl2O

5,659

2-(Diphenylphosphino)biphenyl 98.0+%, TCI America™

CAS: 13885-09-1 Molecular Formula: C24H19P Molecular Weight (g/mol): 338.39 MDL Number: MFCD11559063 InChI Key: FNCQSSIMHQVKGF-UHFFFAOYSA-N Synonym: 2-diphenylphosphino biphenyl,2-diphenylphosphino-biphenyl,1,1'-biphenyl-2-yldiphenylphosphane,biphenyl-2-yl-diphenyl-phosphane,phosphine, 1,1'-biphenyl yldiphenyl,diphenyl 2-phenylphenyl phosphane,1,1'-biphenyl-2-yldiphenyl-phosphine,ksc494o1b,2-biphenylyl diphenylphosphine,diphenylphosphino-1,1'-biphenyl PubChem CID: 12976978 IUPAC Name: {[1,1'-biphenyl]-2-yl}diphenylphosphane SMILES: C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1C1=CC=CC=C1

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Specifications

PubChem CID	12976978
CAS	13885-09-1
Molecular Weight (g/mol)	338.39
MDL Number	MFCD11559063
SMILES	C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1C1=CC=CC=C1
Synonym	2-diphenylphosphino biphenyl,2-diphenylphosphino-biphenyl,1,1'-biphenyl-2-yldiphenylphosphane,biphenyl-2-yl-diphenyl-phosphane,phosphine, 1,1'-biphenyl yldiphenyl,diphenyl 2-phenylphenyl phosphane,1,1'-biphenyl-2-yldiphenyl-phosphine,ksc494o1b,2-biphenylyl diphenylphosphine,diphenylphosphino-1,1'-biphenyl
IUPAC Name	{[1,1'-biphenyl]-2-yl}diphenylphosphane
InChI Key	FNCQSSIMHQVKGF-UHFFFAOYSA-N
Molecular Formula	C24H19P

5,660

Pentafluorophenyl Chlorothionoformate 95.0+%, TCI America™

CAS: 135192-53-9 Molecular Formula: C7ClF5OS Molecular Weight (g/mol): 262.578 MDL Number: MFCD00075405 InChI Key: DKFQHZNKNWNZCO-UHFFFAOYSA-N Synonym: Chlorothioformic Acid O-Pentafluorophenyl Ester, Pentafluorophenyl Thionochloroformate, O-Perfluorophenyl Chlorothioformate PubChem CID: 5214725 IUPAC Name: O-(2,3,4,5,6-pentafluorophenyl) chloromethanethioate SMILES: C1(=C(C(=C(C(=C1F)F)F)F)F)OC(=S)Cl

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Specifications

PubChem CID	5214725
CAS	135192-53-9
Molecular Weight (g/mol)	262.578
MDL Number	MFCD00075405
SMILES	C1(=C(C(=C(C(=C1F)F)F)F)F)OC(=S)Cl
Synonym	Chlorothioformic Acid O-Pentafluorophenyl Ester, Pentafluorophenyl Thionochloroformate, O-Perfluorophenyl Chlorothioformate
IUPAC Name	O-(2,3,4,5,6-pentafluorophenyl) chloromethanethioate
InChI Key	DKFQHZNKNWNZCO-UHFFFAOYSA-N
Molecular Formula	C7ClF5OS

5,661

Tri-o-tolyl Borate 98.0+%, TCI America™

CAS: 2665-12-5 Molecular Formula: C21H21BO3 Molecular Weight (g/mol): 332.21 MDL Number: MFCD00059311 InChI Key: RTMBXAOPKJNOGZ-UHFFFAOYSA-N Synonym: Boric Acid Tri-o-cresyl Ester, Tri-o-cresyl Borate, Boric Acid Tri-o-tolyl Ester PubChem CID: 75875 IUPAC Name: tris(2-methylphenyl) borate SMILES: B(OC1=CC=CC=C1C)(OC2=CC=CC=C2C)OC3=CC=CC=C3C

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Specifications

PubChem CID	75875
CAS	2665-12-5
Molecular Weight (g/mol)	332.21
MDL Number	MFCD00059311
SMILES	B(OC1=CC=CC=C1C)(OC2=CC=CC=C2C)OC3=CC=CC=C3C
Synonym	Boric Acid Tri-o-cresyl Ester, Tri-o-cresyl Borate, Boric Acid Tri-o-tolyl Ester
IUPAC Name	tris(2-methylphenyl) borate
InChI Key	RTMBXAOPKJNOGZ-UHFFFAOYSA-N
Molecular Formula	C21H21BO3

5,662

3,5-Bis[3,5-bis(benzyloxy)benzyloxy]benzyl Bromide 97.0+%, TCI America™

CAS: 129536-41-0 Molecular Formula: C49H43BrO6 Molecular Weight (g/mol): 807.781 MDL Number: MFCD02093449 InChI Key: WEIQDYRDUFADRJ-UHFFFAOYSA-N Synonym: 3,5-Bis(3,5-dibenzyloxybenzyloxy)benzyl Bromide PubChem CID: 11967226 IUPAC Name: 1,3-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-5-(bromomethyl)benzene SMILES: C1=CC=C(C=C1)COC2=CC(=CC(=C2)COC3=CC(=CC(=C3)CBr)OCC4=CC(=CC(=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7

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Specifications

PubChem CID	11967226
CAS	129536-41-0
Molecular Weight (g/mol)	807.781
MDL Number	MFCD02093449
SMILES	C1=CC=C(C=C1)COC2=CC(=CC(=C2)COC3=CC(=CC(=C3)CBr)OCC4=CC(=CC(=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)OCC7=CC=CC=C7
Synonym	3,5-Bis(3,5-dibenzyloxybenzyloxy)benzyl Bromide
IUPAC Name	1,3-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]-5-(bromomethyl)benzene
InChI Key	WEIQDYRDUFADRJ-UHFFFAOYSA-N
Molecular Formula	C49H43BrO6

5,663

2,4-Dichlorobenzophenone 97.0+%, TCI America™

CAS: 19811-05-3 Molecular Formula: C13H8Cl2O Molecular Weight (g/mol): 251.11 MDL Number: MFCD00018374 InChI Key: VLTYTTRXESKBKI-UHFFFAOYSA-N PubChem CID: 72867 IUPAC Name: (2,4-dichlorophenyl)(phenyl)methanone SMILES: ClC1=CC=C(C(=O)C2=CC=CC=C2)C(Cl)=C1

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Specifications

PubChem CID	72867
CAS	19811-05-3
Molecular Weight (g/mol)	251.11
MDL Number	MFCD00018374
SMILES	ClC1=CC=C(C(=O)C2=CC=CC=C2)C(Cl)=C1
IUPAC Name	(2,4-dichlorophenyl)(phenyl)methanone
InChI Key	VLTYTTRXESKBKI-UHFFFAOYSA-N
Molecular Formula	C13H8Cl2O

5,664

4,4'-(4,4'-Isopropylidenediphenoxy)diphthalic Anhydride 98.0+%, TCI America™

CAS: 38103-06-9 Molecular Formula: C31H20O8 Molecular Weight (g/mol): 520.49 MDL Number: MFCD00319167 InChI Key: MQAHXEQUBNDFGI-UHFFFAOYSA-N PubChem CID: 94483 IUPAC Name: 5-[4-(2-{4-[(1,3-dioxo-1,3-dihydro-2-benzofuran-5-yl)oxy]phenyl}propan-2-yl)phenoxy]-1,3-dihydro-2-benzofuran-1,3-dione SMILES: CC(C)(C1=CC=C(OC2=CC=C3C(=O)OC(=O)C3=C2)C=C1)C1=CC=C(OC2=CC=C3C(=O)OC(=O)C3=C2)C=C1

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Specifications

PubChem CID	94483
CAS	38103-06-9
Molecular Weight (g/mol)	520.49
MDL Number	MFCD00319167
SMILES	CC(C)(C1=CC=C(OC2=CC=C3C(=O)OC(=O)C3=C2)C=C1)C1=CC=C(OC2=CC=C3C(=O)OC(=O)C3=C2)C=C1
IUPAC Name	5-[4-(2-{4-[(1,3-dioxo-1,3-dihydro-2-benzofuran-5-yl)oxy]phenyl}propan-2-yl)phenoxy]-1,3-dihydro-2-benzofuran-1,3-dione
InChI Key	MQAHXEQUBNDFGI-UHFFFAOYSA-N
Molecular Formula	C31H20O8

5,665

2-tert-Butyl-4-ethylphenol 97.0+%, TCI America™

CAS: 96-70-8 Molecular Formula: C12H18O Molecular Weight (g/mol): 178.28 MDL Number: MFCD00069413 InChI Key: LZHCVNIARUXHAL-UHFFFAOYSA-N PubChem CID: 7309 IUPAC Name: 2-tert-butyl-4-ethylphenol SMILES: CCC1=CC=C(O)C(=C1)C(C)(C)C

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Specifications

PubChem CID	7309
CAS	96-70-8
Molecular Weight (g/mol)	178.28
MDL Number	MFCD00069413
SMILES	CCC1=CC=C(O)C(=C1)C(C)(C)C
IUPAC Name	2-tert-butyl-4-ethylphenol
InChI Key	LZHCVNIARUXHAL-UHFFFAOYSA-N
Molecular Formula	C12H18O

5,666

2,4,6-Tribromoaniline 98.0+%, TCI America™

CAS: 147-82-0 Molecular Formula: C6H4Br3N Molecular Weight (g/mol): 329.82 MDL Number: MFCD00007634 InChI Key: GVPODVKBTHCGFU-UHFFFAOYSA-N Synonym: benzenamine, 2,4,6-tribromo,s-tribromoaniline,2,4,6-tribromophenylamine,2,4,6-tribromobenzenamine,sym-tribromoaniline,aniline tribromide,tribromoaniline,usaf do-43,aniline, 2,4,6-tribromo,2,4,6-tribomoaniline PubChem CID: 8986 IUPAC Name: 2,4,6-tribromoaniline SMILES: NC1=C(Br)C=C(Br)C=C1Br

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Specifications

PubChem CID	8986
CAS	147-82-0
Molecular Weight (g/mol)	329.82
MDL Number	MFCD00007634
SMILES	NC1=C(Br)C=C(Br)C=C1Br
Synonym	benzenamine, 2,4,6-tribromo,s-tribromoaniline,2,4,6-tribromophenylamine,2,4,6-tribromobenzenamine,sym-tribromoaniline,aniline tribromide,tribromoaniline,usaf do-43,aniline, 2,4,6-tribromo,2,4,6-tribomoaniline
IUPAC Name	2,4,6-tribromoaniline
InChI Key	GVPODVKBTHCGFU-UHFFFAOYSA-N
Molecular Formula	C6H4Br3N

5,667

Ethyl Phenylsulfonylacetate 98.0+%, TCI America™

CAS: 7605-30-3 Molecular Formula: C10H12O4S Molecular Weight (g/mol): 228.262 MDL Number: MFCD00025041 InChI Key: NJBWORPRIRNTLH-UHFFFAOYSA-N Synonym: Phenylsulfonylacetic Acid Ethyl Ester PubChem CID: 82078 IUPAC Name: ethyl 2-(benzenesulfonyl)acetate SMILES: CCOC(=O)CS(=O)(=O)C1=CC=CC=C1

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Specifications

PubChem CID	82078
CAS	7605-30-3
Molecular Weight (g/mol)	228.262
MDL Number	MFCD00025041
SMILES	CCOC(=O)CS(=O)(=O)C1=CC=CC=C1
Synonym	Phenylsulfonylacetic Acid Ethyl Ester
IUPAC Name	ethyl 2-(benzenesulfonyl)acetate
InChI Key	NJBWORPRIRNTLH-UHFFFAOYSA-N
Molecular Formula	C10H12O4S

5,668

Sodium Phenoxyacetate 98.0+%, TCI America™

CAS: 3598-16-1 Molecular Formula: C8H7NaO3 Molecular Weight (g/mol): 174.13 MDL Number: MFCD00064234 InChI Key: WPTJBFNYRRZIDZ-UHFFFAOYSA-M Synonym: Phenoxyacetic Acid Sodium Salt PubChem CID: 23687423 IUPAC Name: sodium 2-phenoxyacetate SMILES: [Na+].[O-]C(=O)COC1=CC=CC=C1

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Specifications

PubChem CID	23687423
CAS	3598-16-1
Molecular Weight (g/mol)	174.13
MDL Number	MFCD00064234
SMILES	[Na+].[O-]C(=O)COC1=CC=CC=C1
Synonym	Phenoxyacetic Acid Sodium Salt
IUPAC Name	sodium 2-phenoxyacetate
InChI Key	WPTJBFNYRRZIDZ-UHFFFAOYSA-M
Molecular Formula	C8H7NaO3

5,669

Diphenyl-1-pyrenylphosphine 95.0+%, TCI America™

CAS: 110231-30-6 Molecular Formula: C28H19P Molecular Weight (g/mol): 386.434 InChI Key: DSYGKYCYNVHCNQ-UHFFFAOYSA-N Synonym: 1-(Diphenylphosphino)pyrene, DPPP PubChem CID: 130626 IUPAC Name: diphenyl(pyren-1-yl)phosphane SMILES: C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3

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Specifications

PubChem CID	130626
CAS	110231-30-6
Molecular Weight (g/mol)	386.434
SMILES	C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=C4C=CC5=CC=CC6=C5C4=C(C=C6)C=C3
Synonym	1-(Diphenylphosphino)pyrene, DPPP
IUPAC Name	diphenyl(pyren-1-yl)phosphane
InChI Key	DSYGKYCYNVHCNQ-UHFFFAOYSA-N
Molecular Formula	C28H19P

5,670

2-(4-Fluorophenyl)thiophene 95.0+%, TCI America™

CAS: 58861-48-6 Molecular Formula: C10H7FS Molecular Weight (g/mol): 178.224 MDL Number: MFCD06802535 InChI Key: PURJRGMZIKXDMW-UHFFFAOYSA-N PubChem CID: 21894783 IUPAC Name: 2-(4-fluorophenyl)thiophene SMILES: C1=CSC(=C1)C2=CC=C(C=C2)F

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Specifications

PubChem CID	21894783
CAS	58861-48-6
Molecular Weight (g/mol)	178.224
MDL Number	MFCD06802535
SMILES	C1=CSC(=C1)C2=CC=C(C=C2)F
IUPAC Name	2-(4-fluorophenyl)thiophene
InChI Key	PURJRGMZIKXDMW-UHFFFAOYSA-N
Molecular Formula	C10H7FS

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