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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5,536 – 5,550 of 75,046 results

5,536

2-Amino-4-chlorodiphenyl Ether 98.0+%, TCI America™

CAS: 93-67-4 Molecular Formula: C12H10ClNO Molecular Weight (g/mol): 219.668 MDL Number: MFCD00025217 InChI Key: SXEBHIMOUHBBOS-UHFFFAOYSA-N Synonym: 2-amino-4-chlorophenyl phenyl ether,benzenamine, 5-chloro-2-phenoxy,4-chlor-2-aminodiphenylether,2-amino-4-chlorodiphenyl ether,5-chloro-2-phenoxy-aniline,unii-66sm796mdb,5-chloro-2-phenoxybenzenamine,5-chloro-2-phenoxyphenylamine,2-amino-4-chlorodiphenylether,4-chloro-2-aminodiphenyl ether PubChem CID: 66738 IUPAC Name: 5-chloro-2-phenoxyaniline SMILES: C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)N

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Specifications

PubChem CID	66738
CAS	93-67-4
Molecular Weight (g/mol)	219.668
MDL Number	MFCD00025217
SMILES	C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)N
Synonym	2-amino-4-chlorophenyl phenyl ether,benzenamine, 5-chloro-2-phenoxy,4-chlor-2-aminodiphenylether,2-amino-4-chlorodiphenyl ether,5-chloro-2-phenoxy-aniline,unii-66sm796mdb,5-chloro-2-phenoxybenzenamine,5-chloro-2-phenoxyphenylamine,2-amino-4-chlorodiphenylether,4-chloro-2-aminodiphenyl ether
IUPAC Name	5-chloro-2-phenoxyaniline
InChI Key	SXEBHIMOUHBBOS-UHFFFAOYSA-N
Molecular Formula	C12H10ClNO

5,537

4,4'-Diaminodiphenyl Ether 98.0+%, TCI America™

CAS: 101-80-4 Molecular Formula: C12H12N2O Molecular Weight (g/mol): 200.241 MDL Number: MFCD00007863 InChI Key: HLBLWEWZXPIGSM-UHFFFAOYSA-N Synonym: 4,4'-oxydianiline,4,4'-diaminodiphenyl ether,4,4-oxydianiline,4-aminophenyl ether,4,4'-oxybisbenzenamine,oxydianiline,4-4-aminophenoxy aniline,diaminodiphenyl ether,benzenamine, 4,4'-oxybis,p,p'-oxydianiline PubChem CID: 7579 ChEBI: CHEBI:34384 IUPAC Name: 4-(4-aminophenoxy)aniline SMILES: C1=CC(=CC=C1N)OC2=CC=C(C=C2)N

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Specifications

PubChem CID	7579
CAS	101-80-4
Molecular Weight (g/mol)	200.241
ChEBI	CHEBI:34384
MDL Number	MFCD00007863
SMILES	C1=CC(=CC=C1N)OC2=CC=C(C=C2)N
Synonym	4,4'-oxydianiline,4,4'-diaminodiphenyl ether,4,4-oxydianiline,4-aminophenyl ether,4,4'-oxybisbenzenamine,oxydianiline,4-4-aminophenoxy aniline,diaminodiphenyl ether,benzenamine, 4,4'-oxybis,p,p'-oxydianiline
IUPAC Name	4-(4-aminophenoxy)aniline
InChI Key	HLBLWEWZXPIGSM-UHFFFAOYSA-N
Molecular Formula	C12H12N2O

5,538

1,3-Bis(4-methoxyphenyl)thiourea 98.0+%, TCI America™

CAS: 1227-45-8 Molecular Formula: C15H16N2O2S Molecular Weight (g/mol): 288.365 MDL Number: MFCD00025792 InChI Key: RGRJEERVXALLTH-UHFFFAOYSA-N PubChem CID: 706970 IUPAC Name: 1,3-bis(4-methoxyphenyl)thiourea SMILES: COC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)OC

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Specifications

PubChem CID	706970
CAS	1227-45-8
Molecular Weight (g/mol)	288.365
MDL Number	MFCD00025792
SMILES	COC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)OC
IUPAC Name	1,3-bis(4-methoxyphenyl)thiourea
InChI Key	RGRJEERVXALLTH-UHFFFAOYSA-N
Molecular Formula	C15H16N2O2S

5,539

N1-(tert-Butoxycarbonyl)-4-fluoro-1,2-phenylenediamine 98.0+%, TCI America™

CAS: 579474-47-8 Molecular Formula: C11H15FN2O2 Molecular Weight (g/mol): 226.25 MDL Number: MFCD09701246 InChI Key: IBKSOWUYKOORFF-UHFFFAOYSA-N Synonym: N1-Boc-4-fluoro-1,2-phenylenediamine, tert-Butyl (2-Amino-4-fluorophenyl)carbamate, (2-Amino-4-fluorophenyl)carbamic Acid tert-Butyl Ester PubChem CID: 24688763 IUPAC Name: tert-butyl N-(2-amino-4-fluorophenyl)carbamate SMILES: CC(C)(C)OC(=O)NC1=C(N)C=C(F)C=C1

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Specifications

PubChem CID	24688763
CAS	579474-47-8
Molecular Weight (g/mol)	226.25
MDL Number	MFCD09701246
SMILES	CC(C)(C)OC(=O)NC1=C(N)C=C(F)C=C1
Synonym	N1-Boc-4-fluoro-1,2-phenylenediamine, tert-Butyl (2-Amino-4-fluorophenyl)carbamate, (2-Amino-4-fluorophenyl)carbamic Acid tert-Butyl Ester
IUPAC Name	tert-butyl N-(2-amino-4-fluorophenyl)carbamate
InChI Key	IBKSOWUYKOORFF-UHFFFAOYSA-N
Molecular Formula	C11H15FN2O2

5,540

2-Nitrophenol Sodium Salt 99.0+%, TCI America™

CAS: 824-39-5 Molecular Formula: C6H4NNaO3 Molecular Weight (g/mol): 161.092 MDL Number: MFCD00065178 InChI Key: AXKBOWBNOCUNJL-UHFFFAOYSA-M Synonym: Sodium 2-Nitrophenol PubChem CID: 69985 IUPAC Name: sodium;2-nitrophenolate SMILES: C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]

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Specifications

PubChem CID	69985
CAS	824-39-5
Molecular Weight (g/mol)	161.092
MDL Number	MFCD00065178
SMILES	C1=CC=C(C(=C1)[N+](=O)[O-])[O-].[Na+]
Synonym	Sodium 2-Nitrophenol
IUPAC Name	sodium;2-nitrophenolate
InChI Key	AXKBOWBNOCUNJL-UHFFFAOYSA-M
Molecular Formula	C6H4NNaO3

5,541

Bis(8-quinolinolato)zinc(II) Hydrate 93.0+%, TCI America™

CAS: 13978-85-3 Molecular Formula: C18H12N2O2Zn Molecular Weight (g/mol): 353.686 MDL Number: MFCD00065291 InChI Key: HTPBWAPZAJWXKY-UHFFFAOYSA-L Synonym: zinc 8-quinolinolate,zinc oxyquinolate,bis 8-quinolinolato zinc,zinc quinolin-8-olate,unii-2p1rtx6vak,bis 8-hydroxyquinolinato zinc,2p1rtx6vak,bis 8-quinolinolato zinc ii,bis 8-hydroxyquinolinato zinc ii,8-hydroxyquinoline, zinc salt PubChem CID: 84127 IUPAC Name: zinc;quinolin-8-olate SMILES: C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Zn+2]

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Specifications

PubChem CID	84127
CAS	13978-85-3
Molecular Weight (g/mol)	353.686
MDL Number	MFCD00065291
SMILES	C1=CC2=C(C(=C1)[O-])N=CC=C2.C1=CC2=C(C(=C1)[O-])N=CC=C2.[Zn+2]
Synonym	zinc 8-quinolinolate,zinc oxyquinolate,bis 8-quinolinolato zinc,zinc quinolin-8-olate,unii-2p1rtx6vak,bis 8-hydroxyquinolinato zinc,2p1rtx6vak,bis 8-quinolinolato zinc ii,bis 8-hydroxyquinolinato zinc ii,8-hydroxyquinoline, zinc salt
IUPAC Name	zinc;quinolin-8-olate
InChI Key	HTPBWAPZAJWXKY-UHFFFAOYSA-L
Molecular Formula	C18H12N2O2Zn

5,542

1,3-Bis(4-chlorophenyl)thiourea 98.0+%, TCI America™

CAS: 1220-00-4 Molecular Formula: C13H10Cl2N2S Molecular Weight (g/mol): 297.20 MDL Number: MFCD00275761 InChI Key: SYJZYFOTCABQES-UHFFFAOYSA-N PubChem CID: 2798589 IUPAC Name: 1,3-bis(4-chlorophenyl)thiourea SMILES: ClC1=CC=C(NC(=S)NC2=CC=C(Cl)C=C2)C=C1

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Specifications

PubChem CID	2798589
CAS	1220-00-4
Molecular Weight (g/mol)	297.20
MDL Number	MFCD00275761
SMILES	ClC1=CC=C(NC(=S)NC2=CC=C(Cl)C=C2)C=C1
IUPAC Name	1,3-bis(4-chlorophenyl)thiourea
InChI Key	SYJZYFOTCABQES-UHFFFAOYSA-N
Molecular Formula	C13H10Cl2N2S

5,543

2-Phenylbutyrophenone 98.0+%, TCI America™

CAS: 16282-16-9 Molecular Formula: C16H16O Molecular Weight (g/mol): 224.303 MDL Number: MFCD00010344 InChI Key: UHKJKVIZTFFFSB-UHFFFAOYSA-N Synonym: 1,2-diphenyl-1-butanone,alpha-ethyldeoxybenzoin,alpha-ethyl deoxybenzoin,2-phenylbutyrophenone,1,2-diphenyl-butan-1-one,1-butanone, 1,2-diphenyl,phenylbutyrophenone,pubchem20785,butyrophenone, 2-phenyl,1-butanone,1,2-diphenyl PubChem CID: 297636 IUPAC Name: 1,2-diphenylbutan-1-one SMILES: CCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2

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Specifications

PubChem CID	297636
CAS	16282-16-9
Molecular Weight (g/mol)	224.303
MDL Number	MFCD00010344
SMILES	CCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2
Synonym	1,2-diphenyl-1-butanone,alpha-ethyldeoxybenzoin,alpha-ethyl deoxybenzoin,2-phenylbutyrophenone,1,2-diphenyl-butan-1-one,1-butanone, 1,2-diphenyl,phenylbutyrophenone,pubchem20785,butyrophenone, 2-phenyl,1-butanone,1,2-diphenyl
IUPAC Name	1,2-diphenylbutan-1-one
InChI Key	UHKJKVIZTFFFSB-UHFFFAOYSA-N
Molecular Formula	C16H16O

5,544

2-Phenylphenol Sodium Salt Tetrahydrate 80.0+%, TCI America™

CAS: 132-27-4 Molecular Formula: C12H9NaO Molecular Weight (g/mol): 192.193 MDL Number: MFCD00002209 InChI Key: KSQXVLVXUFHGJQ-UHFFFAOYSA-M Synonym: sodium 1,1'-biphenyl-2-olate,sodium 2-biphenylate,sodium o-phenylphenate,2-phenylphenol sodium salt,natriphene,orphenol,bactrol,o-phenylphenol sodium,sodium o-phenylphenol,dowicide a PubChem CID: 23675735 ChEBI: CHEBI:82371 IUPAC Name: sodium;2-phenylphenolate SMILES: C1=CC=C(C=C1)C2=CC=CC=C2[O-].[Na+]

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Specifications

PubChem CID	23675735
CAS	132-27-4
Molecular Weight (g/mol)	192.193
ChEBI	CHEBI:82371
MDL Number	MFCD00002209
SMILES	C1=CC=C(C=C1)C2=CC=CC=C2[O-].[Na+]
Synonym	sodium 1,1'-biphenyl-2-olate,sodium 2-biphenylate,sodium o-phenylphenate,2-phenylphenol sodium salt,natriphene,orphenol,bactrol,o-phenylphenol sodium,sodium o-phenylphenol,dowicide a
IUPAC Name	sodium;2-phenylphenolate
InChI Key	KSQXVLVXUFHGJQ-UHFFFAOYSA-M
Molecular Formula	C12H9NaO

5,545

2-Bromo-4,5-dimethoxybenzoic Acid 98.0+%, TCI America™

CAS: 6286-46-0 Molecular Formula: C9H9BrO4 Molecular Weight (g/mol): 261.07 MDL Number: MFCD00017542 InChI Key: HWFCHCRFQWEFMU-UHFFFAOYSA-N Synonym: 6-bromoveratric acid,benzoic acid, 2-bromo-4,5-dimethoxy,2-bromo-4,5-dimethoxybenzoicacid,6-bromo-3,4-dimethoxybenzoic acid,6-bromveratrumsaure,acmc-1b7v8,ksc496e4l,rarechem al be 0015,timtec-bb sbb037916 PubChem CID: 222963 IUPAC Name: 2-bromo-4,5-dimethoxybenzoic acid SMILES: COC1=CC(Br)=C(C=C1OC)C(O)=O

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Specifications

PubChem CID	222963
CAS	6286-46-0
Molecular Weight (g/mol)	261.07
MDL Number	MFCD00017542
SMILES	COC1=CC(Br)=C(C=C1OC)C(O)=O
Synonym	6-bromoveratric acid,benzoic acid, 2-bromo-4,5-dimethoxy,2-bromo-4,5-dimethoxybenzoicacid,6-bromo-3,4-dimethoxybenzoic acid,6-bromveratrumsaure,acmc-1b7v8,ksc496e4l,rarechem al be 0015,timtec-bb sbb037916
IUPAC Name	2-bromo-4,5-dimethoxybenzoic acid
InChI Key	HWFCHCRFQWEFMU-UHFFFAOYSA-N
Molecular Formula	C9H9BrO4

5,546

4-Phenylsemicarbazide 98.0+%, TCI America™

CAS: 537-47-3 Molecular Formula: C7H9N3O Molecular Weight (g/mol): 151.169 MDL Number: MFCD00007590 InChI Key: MOCKWYUCPREFCZ-UHFFFAOYSA-N Synonym: 4-phenylsemicarbazide,n-phenylhydrazinecarboxamide,3-amino-1-phenylurea,hydrazinecarboxamide, n-phenyl,anilinoformylhydrazine,unii-bpu96sx57a,semicarbazide, 4-phenyl,bpu96sx57a,hydrazinecarboxanilide,anilinocarbonylhydrazine PubChem CID: 10837 IUPAC Name: 1-amino-3-phenylurea SMILES: C1=CC=C(C=C1)NC(=O)NN

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PubChem CID	10837
CAS	537-47-3
Molecular Weight (g/mol)	151.169
MDL Number	MFCD00007590
SMILES	C1=CC=C(C=C1)NC(=O)NN
Synonym	4-phenylsemicarbazide,n-phenylhydrazinecarboxamide,3-amino-1-phenylurea,hydrazinecarboxamide, n-phenyl,anilinoformylhydrazine,unii-bpu96sx57a,semicarbazide, 4-phenyl,bpu96sx57a,hydrazinecarboxanilide,anilinocarbonylhydrazine
IUPAC Name	1-amino-3-phenylurea
InChI Key	MOCKWYUCPREFCZ-UHFFFAOYSA-N
Molecular Formula	C7H9N3O

5,547

(4-Nitrophenyl)urea 98.0+%, TCI America™

CAS: 556-10-5 Molecular Formula: C7H7N3O3 Molecular Weight (g/mol): 181.151 MDL Number: MFCD09040599 InChI Key: LXXTVGKSGJADFU-UHFFFAOYSA-N PubChem CID: 313520 IUPAC Name: (4-nitrophenyl)urea SMILES: C1=CC(=CC=C1NC(=O)N)[N+](=O)[O-]

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Specifications

PubChem CID	313520
CAS	556-10-5
Molecular Weight (g/mol)	181.151
MDL Number	MFCD09040599
SMILES	C1=CC(=CC=C1NC(=O)N)[N+](=O)[O-]
IUPAC Name	(4-nitrophenyl)urea
InChI Key	LXXTVGKSGJADFU-UHFFFAOYSA-N
Molecular Formula	C7H7N3O3

5,548

4-(trans-4-Butylcyclohexyl)phenol 98.0+%, TCI America™

CAS: 88581-00-4 Molecular Formula: C16H24O Molecular Weight (g/mol): 232.367 MDL Number: MFCD00673752 InChI Key: SJXVTMAQPHVBEG-UHFFFAOYSA-N Synonym: 1-(trans-4-Butylcyclohexyl)-4-hydroxybenzene PubChem CID: 19845546 IUPAC Name: 4-(4-butylcyclohexyl)phenol SMILES: CCCCC1CCC(CC1)C2=CC=C(C=C2)O

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Specifications

PubChem CID	19845546
CAS	88581-00-4
Molecular Weight (g/mol)	232.367
MDL Number	MFCD00673752
SMILES	CCCCC1CCC(CC1)C2=CC=C(C=C2)O
Synonym	1-(trans-4-Butylcyclohexyl)-4-hydroxybenzene
IUPAC Name	4-(4-butylcyclohexyl)phenol
InChI Key	SJXVTMAQPHVBEG-UHFFFAOYSA-N
Molecular Formula	C16H24O

5,549

4-(trans-4-Propylcyclohexyl)phenol 98.0+%, TCI America™

CAS: 81936-33-6 Molecular Formula: C15H22O Molecular Weight (g/mol): 218.34 MDL Number: MFCD00673751 InChI Key: AHAZEMSUUYFDMM-UHFFFAOYSA-N Synonym: 1-Hydroxy-4-(trans-4-propylcyclohexyl)benzene PubChem CID: 3126231 IUPAC Name: 4-(4-propylcyclohexyl)phenol SMILES: CCCC1CCC(CC1)C2=CC=C(C=C2)O

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Specifications

PubChem CID	3126231
CAS	81936-33-6
Molecular Weight (g/mol)	218.34
MDL Number	MFCD00673751
SMILES	CCCC1CCC(CC1)C2=CC=C(C=C2)O
Synonym	1-Hydroxy-4-(trans-4-propylcyclohexyl)benzene
IUPAC Name	4-(4-propylcyclohexyl)phenol
InChI Key	AHAZEMSUUYFDMM-UHFFFAOYSA-N
Molecular Formula	C15H22O

5,550

4-(1-Adamantyl)phenol 99.0+%, TCI America™

CAS: 29799-07-3 Molecular Formula: C16H20O Molecular Weight (g/mol): 228.335 MDL Number: MFCD00168143 InChI Key: KZMYFIUFUAOZHP-UHFFFAOYSA-N Synonym: 1-(4-Hydroxyphenyl)adamantane PubChem CID: 269933 IUPAC Name: 4-(1-adamantyl)phenol SMILES: C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)O

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Specifications

PubChem CID	269933
CAS	29799-07-3
Molecular Weight (g/mol)	228.335
MDL Number	MFCD00168143
SMILES	C1C2CC3CC1CC(C2)(C3)C4=CC=C(C=C4)O
Synonym	1-(4-Hydroxyphenyl)adamantane
IUPAC Name	4-(1-adamantyl)phenol
InChI Key	KZMYFIUFUAOZHP-UHFFFAOYSA-N
Molecular Formula	C16H20O

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