Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.

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6,076 – 6,090 of 158,371 results

6,076

Phenylbis(2,4,6-trimethylbenzoyl)phosphine Oxide 96.0+%, TCI America™

CAS: 162881-26-7 Molecular Formula: C26H27O3P Molecular Weight (g/mol): 418.473 MDL Number: MFCD01863675 InChI Key: GUCYFKSBFREPBC-UHFFFAOYSA-N Synonym: BAPO PubChem CID: 164512 IUPAC Name: [phenyl-(2,4,6-trimethylbenzoyl)phosphoryl]-(2,4,6-trimethylphenyl)methanone SMILES: CC1=CC(=C(C(=C1)C)C(=O)P(=O)(C2=CC=CC=C2)C(=O)C3=C(C=C(C=C3C)C)C)C

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Specifications

PubChem CID	164512
CAS	162881-26-7
Molecular Weight (g/mol)	418.473
MDL Number	MFCD01863675
SMILES	CC1=CC(=C(C(=C1)C)C(=O)P(=O)(C2=CC=CC=C2)C(=O)C3=C(C=C(C=C3C)C)C)C
Synonym	BAPO
IUPAC Name	[phenyl-(2,4,6-trimethylbenzoyl)phosphoryl]-(2,4,6-trimethylphenyl)methanone
InChI Key	GUCYFKSBFREPBC-UHFFFAOYSA-N
Molecular Formula	C26H27O3P

6,077

4-(Trifluoromethyl)benzenesulfonyl Chloride 98.0+%, TCI America™

CAS: 2991-42-6 Molecular Formula: C7H4ClF3O2S Molecular Weight (g/mol): 244.61 MDL Number: MFCD00042422 InChI Key: OZDCZHDOIBUGAJ-UHFFFAOYSA-N Synonym: 4-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzene-1-sulfonyl chloride,4-trifluoromethyl benzene sulfonyl chloride,p-trifluoromethylbenzenesulfonyl chloride,4-trifluoromethyl benzenesulfonylchloride,4-trifluoromethyl-benzenesulfonyl chloride,4-trifluoromethyl phenylsulfonyl chloride,p-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzenesulphonyl chloride,benzenesulfonyl chloride, 4-trifluoromethyl PubChem CID: 2777399 IUPAC Name: 4-(trifluoromethyl)benzene-1-sulfonyl chloride SMILES: FC(F)(F)C1=CC=C(C=C1)S(Cl)(=O)=O

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Specifications

PubChem CID	2777399
CAS	2991-42-6
Molecular Weight (g/mol)	244.61
MDL Number	MFCD00042422
SMILES	FC(F)(F)C1=CC=C(C=C1)S(Cl)(=O)=O
Synonym	4-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzene-1-sulfonyl chloride,4-trifluoromethyl benzene sulfonyl chloride,p-trifluoromethylbenzenesulfonyl chloride,4-trifluoromethyl benzenesulfonylchloride,4-trifluoromethyl-benzenesulfonyl chloride,4-trifluoromethyl phenylsulfonyl chloride,p-trifluoromethyl benzenesulfonyl chloride,4-trifluoromethyl benzenesulphonyl chloride,benzenesulfonyl chloride, 4-trifluoromethyl
IUPAC Name	4-(trifluoromethyl)benzene-1-sulfonyl chloride
InChI Key	OZDCZHDOIBUGAJ-UHFFFAOYSA-N
Molecular Formula	C7H4ClF3O2S

6,078

Triphenylmethanethiol 97.0+%, TCI America™

CAS: 3695-77-0 Molecular Formula: C19H16S Molecular Weight (g/mol): 276.397 MDL Number: MFCD00004854 InChI Key: JQZIKLPHXXBMCA-UHFFFAOYSA-N Synonym: triphenylmethyl mercaptan,trityl mercaptan,tritylthiol,triphenylmethylmercaptan,methanethiol, triphenyl,tritylmercaptan,triphenyl-methanethiol,alpha,alpha-diphenylbenzenemethanethiol,benzenemethanethiol, alpha,alpha-diphenyl,benzenemethanethiol, .alpha.,.alpha.-diphenyl PubChem CID: 77281 IUPAC Name: triphenylmethanethiol SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)S

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Specifications

PubChem CID	77281
CAS	3695-77-0
Molecular Weight (g/mol)	276.397
MDL Number	MFCD00004854
SMILES	C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)S
Synonym	triphenylmethyl mercaptan,trityl mercaptan,tritylthiol,triphenylmethylmercaptan,methanethiol, triphenyl,tritylmercaptan,triphenyl-methanethiol,alpha,alpha-diphenylbenzenemethanethiol,benzenemethanethiol, alpha,alpha-diphenyl,benzenemethanethiol, .alpha.,.alpha.-diphenyl
IUPAC Name	triphenylmethanethiol
InChI Key	JQZIKLPHXXBMCA-UHFFFAOYSA-N
Molecular Formula	C19H16S

6,079

2-Amino-4-bromophenol 98.0+%, TCI America™

CAS: 40925-68-6 Molecular Formula: C6H6BrNO Molecular Weight (g/mol): 188.02 MDL Number: MFCD00235171 InChI Key: JHRIPENGTGSNPJ-UHFFFAOYSA-N Synonym: phenol, 2-amino-4-bromo,5-bromo-2-hydroxyaniline,4-bromo-2-aminophenol,2-amino-4-bromo-phenol,2-amino-4-bromophenole,2-amino-4bromophenol,pubchem4511,acmc-209jho,2-amino4-bromophenol,ksc493s8p PubChem CID: 351840 IUPAC Name: 2-amino-4-bromophenol SMILES: NC1=CC(Br)=CC=C1O

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PubChem CID	351840
CAS	40925-68-6
Molecular Weight (g/mol)	188.02
MDL Number	MFCD00235171
SMILES	NC1=CC(Br)=CC=C1O
Synonym	phenol, 2-amino-4-bromo,5-bromo-2-hydroxyaniline,4-bromo-2-aminophenol,2-amino-4-bromo-phenol,2-amino-4-bromophenole,2-amino-4bromophenol,pubchem4511,acmc-209jho,2-amino4-bromophenol,ksc493s8p
IUPAC Name	2-amino-4-bromophenol
InChI Key	JHRIPENGTGSNPJ-UHFFFAOYSA-N
Molecular Formula	C6H6BrNO

6,080

Dimethyl Terephthalate 99.0+%, TCI America™

CAS: 120-61-6 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.19 MDL Number: MFCD00008440 InChI Key: WOZVHXUHUFLZGK-UHFFFAOYSA-N Synonym: dimethyl terephthalate,dimethyl p-phthalate,1,4-benzenedicarboxylic acid, dimethyl ester,dimethyl p-benzenedicarboxylate,di-me terephthalate,dimethyl 4-phthalate,terephthalic acid, dimethyl ester,dimethyl 1,4-benzenedicarboxylate,terephthalic acid dimethyl ester,methyl p-methoxycarbonyl benzoate PubChem CID: 8441 IUPAC Name: 1,4-dimethyl benzene-1,4-dicarboxylate SMILES: COC(=O)C1=CC=C(C=C1)C(=O)OC

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Specifications

PubChem CID	8441
CAS	120-61-6
Molecular Weight (g/mol)	194.19
MDL Number	MFCD00008440
SMILES	COC(=O)C1=CC=C(C=C1)C(=O)OC
Synonym	dimethyl terephthalate,dimethyl p-phthalate,1,4-benzenedicarboxylic acid, dimethyl ester,dimethyl p-benzenedicarboxylate,di-me terephthalate,dimethyl 4-phthalate,terephthalic acid, dimethyl ester,dimethyl 1,4-benzenedicarboxylate,terephthalic acid dimethyl ester,methyl p-methoxycarbonyl benzoate
IUPAC Name	1,4-dimethyl benzene-1,4-dicarboxylate
InChI Key	WOZVHXUHUFLZGK-UHFFFAOYSA-N
Molecular Formula	C10H10O4

6,081

2-Benzyl-4-chlorophenol 97.0+%, TCI America™

CAS: 120-32-1 Molecular Formula: C13H11ClO Molecular Weight (g/mol): 218.68 MDL Number: MFCD00020140 InChI Key: NCKMMSIFQUPKCK-UHFFFAOYSA-N Synonym: clorophene,chlorophene,clorofene,o-benzyl-p-chlorophenol,neosabenyl,septiphene,benzylchlorophenol,bio-clave,4-chloro-2-benzylphenol,santophen 1 PubChem CID: 8425 IUPAC Name: 2-benzyl-4-chlorophenol SMILES: OC1=CC=C(Cl)C=C1CC1=CC=CC=C1

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Specifications

PubChem CID	8425
CAS	120-32-1
Molecular Weight (g/mol)	218.68
MDL Number	MFCD00020140
SMILES	OC1=CC=C(Cl)C=C1CC1=CC=CC=C1
Synonym	clorophene,chlorophene,clorofene,o-benzyl-p-chlorophenol,neosabenyl,septiphene,benzylchlorophenol,bio-clave,4-chloro-2-benzylphenol,santophen 1
IUPAC Name	2-benzyl-4-chlorophenol
InChI Key	NCKMMSIFQUPKCK-UHFFFAOYSA-N
Molecular Formula	C13H11ClO

6,082

(S)-(-)-1,1'-Bi-2-naphthol 98.0+%, TCI America™

CAS: 18531-99-2 Molecular Formula: C20H14O2 Molecular Weight (g/mol): 286.33 MDL Number: MFCD00004068 InChI Key: PPTXVXKCQZKFBN-UHFFFAOYSA-N Synonym: 1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol PubChem CID: 11762 IUPAC Name: 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol SMILES: C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O

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Specifications

PubChem CID	11762
CAS	18531-99-2
Molecular Weight (g/mol)	286.33
MDL Number	MFCD00004068
SMILES	C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O
Synonym	1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol
IUPAC Name	1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
InChI Key	PPTXVXKCQZKFBN-UHFFFAOYSA-N
Molecular Formula	C20H14O2

6,083

(R)-(+)-1,1'-Bi-2-naphthol 98.0+%, TCI America™

CAS: 18531-94-7 Molecular Formula: C20H14O2 Molecular Weight (g/mol): 286.33 MDL Number: MFCD00004068 InChI Key: PPTXVXKCQZKFBN-UHFFFAOYSA-N Synonym: 1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol PubChem CID: 11762 IUPAC Name: 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol SMILES: C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O

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Specifications

PubChem CID	11762
CAS	18531-94-7
Molecular Weight (g/mol)	286.33
MDL Number	MFCD00004068
SMILES	C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O
Synonym	1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol
IUPAC Name	1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
InChI Key	PPTXVXKCQZKFBN-UHFFFAOYSA-N
Molecular Formula	C20H14O2

6,084

1-Bromo-4-nitrobenzene 99.0+%, TCI America™

CAS: 586-78-7 Molecular Formula: C6H4BrNO2 Molecular Weight (g/mol): 202.01 MDL Number: MFCD00007280 InChI Key: ZDFBKZUDCQQKAC-UHFFFAOYSA-N Synonym: 4-bromonitrobenzene,4-nitrobromobenzene,p-bromonitrobenzene,benzene, 1-bromo-4-nitro,p-nitrobromobenzene,4-nitrophenyl bromide,4-bromo-1-nitrobenzene,p-nitrophenyl bromide,1-bromo-4-nitro-benzene,ccris 3115 PubChem CID: 11466 IUPAC Name: 1-bromo-4-nitrobenzene SMILES: [O-][N+](=O)C1=CC=C(Br)C=C1

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Specifications

PubChem CID	11466
CAS	586-78-7
Molecular Weight (g/mol)	202.01
MDL Number	MFCD00007280
SMILES	[O-][N+](=O)C1=CC=C(Br)C=C1
Synonym	4-bromonitrobenzene,4-nitrobromobenzene,p-bromonitrobenzene,benzene, 1-bromo-4-nitro,p-nitrobromobenzene,4-nitrophenyl bromide,4-bromo-1-nitrobenzene,p-nitrophenyl bromide,1-bromo-4-nitro-benzene,ccris 3115
IUPAC Name	1-bromo-4-nitrobenzene
InChI Key	ZDFBKZUDCQQKAC-UHFFFAOYSA-N
Molecular Formula	C6H4BrNO2

6,085

N-alpha,N-epsilon-Bis[(9H-fluoren-9-ylmethoxy)carbonyl]-L-lysine 98.0+%, TCI America™

CAS: 78081-87-5 Molecular Formula: C36H34N2O6 Molecular Weight (g/mol): 590.676 MDL Number: MFCD00080275 InChI Key: BMJRTKDVFXYEFS-XIFFEERXSA-N Synonym: fmoc-lys fmoc-oh,n,n'-bis-fmoc-l-lysine,fmoc-l-lys fmoc-oh,n,a,n,a-di-fmoc-l-lysine,2s-2,6-bis 9h-fluoren-9-ylmethoxy carbonyl amino hexanoic acid,fmoclys fmoc oh,pubchem18973,n, n'-bis-fmoc-l-lysine,n-a,n-epsilon-di-fmoc-l-lysine,nalpha,nepsilon-di-fmoc-l-lysine PubChem CID: 13783708 IUPAC Name: (2S)-2,6-bis(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCCCC(C(=O)O)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46

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Specifications

PubChem CID	13783708
CAS	78081-87-5
Molecular Weight (g/mol)	590.676
MDL Number	MFCD00080275
SMILES	C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NCCCCC(C(=O)O)NC(=O)OCC4C5=CC=CC=C5C6=CC=CC=C46
Synonym	fmoc-lys fmoc-oh,n,n'-bis-fmoc-l-lysine,fmoc-l-lys fmoc-oh,n,a,n,a-di-fmoc-l-lysine,2s-2,6-bis 9h-fluoren-9-ylmethoxy carbonyl amino hexanoic acid,fmoclys fmoc oh,pubchem18973,n, n'-bis-fmoc-l-lysine,n-a,n-epsilon-di-fmoc-l-lysine,nalpha,nepsilon-di-fmoc-l-lysine
IUPAC Name	(2S)-2,6-bis(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid
InChI Key	BMJRTKDVFXYEFS-XIFFEERXSA-N
Molecular Formula	C36H34N2O6

6,086

Phenyl Ether 99.0+%, TCI America™

CAS: 101-84-8 Molecular Formula: C12H10O Molecular Weight (g/mol): 170.211 MDL Number: MFCD00003034 InChI Key: USIUVYZYUHIAEV-UHFFFAOYSA-N Synonym: diphenyl ether,diphenyl oxide,phenyl ether,oxydibenzene,phenyl oxide,oxybisbenzene,biphenyl oxide,1,1'-oxydibenzene,benzene, 1,1'-oxybis,oxydiphenyl PubChem CID: 7583 ChEBI: CHEBI:39258 IUPAC Name: phenoxybenzene SMILES: C1=CC=C(C=C1)OC2=CC=CC=C2

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Specifications

PubChem CID	7583
CAS	101-84-8
Molecular Weight (g/mol)	170.211
ChEBI	CHEBI:39258
MDL Number	MFCD00003034
SMILES	C1=CC=C(C=C1)OC2=CC=CC=C2
Synonym	diphenyl ether,diphenyl oxide,phenyl ether,oxydibenzene,phenyl oxide,oxybisbenzene,biphenyl oxide,1,1'-oxydibenzene,benzene, 1,1'-oxybis,oxydiphenyl
IUPAC Name	phenoxybenzene
InChI Key	USIUVYZYUHIAEV-UHFFFAOYSA-N
Molecular Formula	C12H10O

6,087

2-(4-Hydroxyphenyl)ethanol 98.0+%, TCI America™

CAS: 501-94-0 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.166 MDL Number: MFCD00002902 InChI Key: YCCILVSKPBXVIP-UHFFFAOYSA-N Synonym: tyrosol,2-4-hydroxyphenyl ethanol,4-hydroxyphenethyl alcohol,4-2-hydroxyethyl phenol,4-hydroxyphenylethanol,4-hydroxybenzeneethanol,p-hydroxyphenethyl alcohol,benzeneethanol, 4-hydroxy,p-tyrosol,p-hydroxyphenylethanol PubChem CID: 10393 ChEBI: CHEBI:1879 IUPAC Name: 4-(2-hydroxyethyl)phenol SMILES: C1=CC(=CC=C1CCO)O

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Specifications

PubChem CID	10393
CAS	501-94-0
Molecular Weight (g/mol)	138.166
ChEBI	CHEBI:1879
MDL Number	MFCD00002902
SMILES	C1=CC(=CC=C1CCO)O
Synonym	tyrosol,2-4-hydroxyphenyl ethanol,4-hydroxyphenethyl alcohol,4-2-hydroxyethyl phenol,4-hydroxyphenylethanol,4-hydroxybenzeneethanol,p-hydroxyphenethyl alcohol,benzeneethanol, 4-hydroxy,p-tyrosol,p-hydroxyphenylethanol
IUPAC Name	4-(2-hydroxyethyl)phenol
InChI Key	YCCILVSKPBXVIP-UHFFFAOYSA-N
Molecular Formula	C8H10O2

6,088

Vanillin Acetate 98.0+%, TCI America™

CAS: 881-68-5 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00003362 InChI Key: PZSJOBKRSVRODF-UHFFFAOYSA-N Synonym: vanillin acetate,4-acetoxy-3-methoxybenzaldehyde,acetovanillin,acetylvanillin,vanillin, acetate,4-o-acetylvanillin,o-acetylvanillin,benzaldehyde, 4-acetyloxy-3-methoxy,3-methoxy-4-acetoxybenzaldehyde,acetyl vanillin PubChem CID: 61229 ChEBI: CHEBI:86956 IUPAC Name: (4-formyl-2-methoxyphenyl) acetate SMILES: CC(=O)OC1=C(C=C(C=C1)C=O)OC

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Specifications

PubChem CID	61229
CAS	881-68-5
Molecular Weight (g/mol)	194.186
ChEBI	CHEBI:86956
MDL Number	MFCD00003362
SMILES	CC(=O)OC1=C(C=C(C=C1)C=O)OC
Synonym	vanillin acetate,4-acetoxy-3-methoxybenzaldehyde,acetovanillin,acetylvanillin,vanillin, acetate,4-o-acetylvanillin,o-acetylvanillin,benzaldehyde, 4-acetyloxy-3-methoxy,3-methoxy-4-acetoxybenzaldehyde,acetyl vanillin
IUPAC Name	(4-formyl-2-methoxyphenyl) acetate
InChI Key	PZSJOBKRSVRODF-UHFFFAOYSA-N
Molecular Formula	C10H10O4

6,089

4,6-Di-tert-butyl-m-cresol 96.0+%, TCI America™

CAS: 497-39-2 Molecular Formula: C15H24O Molecular Weight (g/mol): 220.356 MDL Number: MFCD00059208 InChI Key: WYSSJDOPILWQDC-UHFFFAOYSA-N Synonym: 2,4-Di-tert-butyl-5-hydroxytoluene, 2,4-Di-tert-butyl-5-methylphenol PubChem CID: 10346 IUPAC Name: 2,4-ditert-butyl-5-methylphenol SMILES: CC1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)O

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Specifications

PubChem CID	10346
CAS	497-39-2
Molecular Weight (g/mol)	220.356
MDL Number	MFCD00059208
SMILES	CC1=CC(=C(C=C1C(C)(C)C)C(C)(C)C)O
Synonym	2,4-Di-tert-butyl-5-hydroxytoluene, 2,4-Di-tert-butyl-5-methylphenol
IUPAC Name	2,4-ditert-butyl-5-methylphenol
InChI Key	WYSSJDOPILWQDC-UHFFFAOYSA-N
Molecular Formula	C15H24O

6,090

2-Hydroxy-4-n-octyloxybenzophenone 98.0+%, TCI America™

CAS: 1843-05-6 Molecular Formula: C21H26O3 Molecular Weight (g/mol): 326.436 MDL Number: MFCD00027327 InChI Key: QUAMTGJKVDWJEQ-UHFFFAOYSA-N Synonym: octabenzone,2-hydroxy-4-n-octyloxybenzophenone,benzophenone-12,2-hydroxy-4-octyloxy phenyl phenyl methanone,benzon oo,2-hydroxy-4-octyloxy benzophenone,benzophenone 12,cyasorb uv 531,spectra-sorb uv 531,sumisorb 130 PubChem CID: 15797 IUPAC Name: (2-hydroxy-4-octoxyphenyl)-phenylmethanone SMILES: CCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O

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Specifications

PubChem CID	15797
CAS	1843-05-6
Molecular Weight (g/mol)	326.436
MDL Number	MFCD00027327
SMILES	CCCCCCCCOC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
Synonym	octabenzone,2-hydroxy-4-n-octyloxybenzophenone,benzophenone-12,2-hydroxy-4-octyloxy phenyl phenyl methanone,benzon oo,2-hydroxy-4-octyloxy benzophenone,benzophenone 12,cyasorb uv 531,spectra-sorb uv 531,sumisorb 130
IUPAC Name	(2-hydroxy-4-octoxyphenyl)-phenylmethanone
InChI Key	QUAMTGJKVDWJEQ-UHFFFAOYSA-N
Molecular Formula	C21H26O3

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