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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.
Benzene and substituted derivatives (65,402)
Phenols (12,144)
Naphthalenes (4,965)
Fluorenes (1,246)
Unsubstituted Phenols (1,180)
Thiophenols (613)
Phenol esters (434)
Anthracenes (402)
Tetralins (329)
Phenanthrenes and derivatives (300)
Indanes (297)
Triphenyl compounds (290)
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Dibenzocycloheptenes (65)
Ellagic acids and derivatives (33)
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1-hydroxylamino 2-unsubstituted benzenoids (5)

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Keyword Search:
7,141 – 7,155 of 74,565 results
7,141

1-Benzhydrylpiperazine 98.0+%, TCI America™
SDP

CAS: 841-77-0 Molecular Formula: C17H20N2 Molecular Weight (g/mol): 252.361 MDL Number: MFCD00038379 InChI Key: NWVNXDKZIQLBNM-UHFFFAOYSA-N Synonym: 1-diphenylmethyl piperazine,benzhydrylpiperazine,n-benzhydrylpiperazine,1-benzhydryl-piperazine,diphenylmethylpiperazine,norcyclizine,normethylcyclizine,piperazine, 1-diphenylmethyl,4-benzhydrylpiperazine,n-diphenylmethyl piperazine PubChem CID: 70048 IUPAC Name: 1-benzhydrylpiperazine SMILES: C1CN(CCN1)C(C2=CC=CC=C2)C3=CC=CC=C3

PubChem CID 70048
CAS 841-77-0
Molecular Weight (g/mol) 252.361
MDL Number MFCD00038379
SMILES C1CN(CCN1)C(C2=CC=CC=C2)C3=CC=CC=C3
Synonym 1-diphenylmethyl piperazine,benzhydrylpiperazine,n-benzhydrylpiperazine,1-benzhydryl-piperazine,diphenylmethylpiperazine,norcyclizine,normethylcyclizine,piperazine, 1-diphenylmethyl,4-benzhydrylpiperazine,n-diphenylmethyl piperazine
IUPAC Name 1-benzhydrylpiperazine
InChI Key NWVNXDKZIQLBNM-UHFFFAOYSA-N
Molecular Formula C17H20N2
7,142

Methyl (R)-(+)-2-(4-Hydroxyphenoxy)propionate 98.0+%, TCI America™
SDP

CAS: 96562-58-2 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00274087 InChI Key: UUYSCNGPNOYZMC-SSDOTTSWSA-N Synonym: methyl r-+-2-4-hydroxyphenoxy propanoate,methyl r-+-2-4-hydroxyphenoxy propionate,r-methyl 2-4-hydroxyphenoxy propanoate,methyl r-2-4-hydroxyphenoxy propionate,r-+-2-4-hydroxyphenoxy propionic acid methyl ester,propanoic acid, 2-4-hydroxyphenoxy-, methyl ester, 2r,methyl 2r-2-4-hydroxyphenoxy propanoate,d-mhpp,aurora ka-6234 PubChem CID: 2733752 IUPAC Name: methyl (2R)-2-(4-hydroxyphenoxy)propanoate SMILES: COC(=O)[C@@H](C)OC1=CC=C(O)C=C1

PubChem CID 2733752
CAS 96562-58-2
Molecular Weight (g/mol) 196.20
MDL Number MFCD00274087
SMILES COC(=O)[C@@H](C)OC1=CC=C(O)C=C1
Synonym methyl r-+-2-4-hydroxyphenoxy propanoate,methyl r-+-2-4-hydroxyphenoxy propionate,r-methyl 2-4-hydroxyphenoxy propanoate,methyl r-2-4-hydroxyphenoxy propionate,r-+-2-4-hydroxyphenoxy propionic acid methyl ester,propanoic acid, 2-4-hydroxyphenoxy-, methyl ester, 2r,methyl 2r-2-4-hydroxyphenoxy propanoate,d-mhpp,aurora ka-6234
IUPAC Name methyl (2R)-2-(4-hydroxyphenoxy)propanoate
InChI Key UUYSCNGPNOYZMC-SSDOTTSWSA-N
Molecular Formula C10H12O4
7,143

1-tert-Butyl-4-iodobenzene 95.0+%, TCI America™
SDP

CAS: 35779-04-5 Molecular Formula: C10H13I Molecular Weight (g/mol): 260.118 MDL Number: MFCD00052339 InChI Key: WQVIVQDHNKQWTM-UHFFFAOYSA-N Synonym: 1-tert-butyl-4-iodobenzene,4-tert-butyliodobenzene,4-t-butyliodobenzene,1-iodo-4-tert-butylbenzene,benzene, 1-1,1-dimethylethyl-4-iodo,4-tert-butyl-1-iodobenzene,2-4-iodophenyl-2-methylpropane,2-4'-iodophenyl-2-methylpropane,pubchem3974,4-t-butyl-iodobenzene PubChem CID: 142029 IUPAC Name: 1-tert-butyl-4-iodobenzene SMILES: CC(C)(C)C1=CC=C(C=C1)I

PubChem CID 142029
CAS 35779-04-5
Molecular Weight (g/mol) 260.118
MDL Number MFCD00052339
SMILES CC(C)(C)C1=CC=C(C=C1)I
Synonym 1-tert-butyl-4-iodobenzene,4-tert-butyliodobenzene,4-t-butyliodobenzene,1-iodo-4-tert-butylbenzene,benzene, 1-1,1-dimethylethyl-4-iodo,4-tert-butyl-1-iodobenzene,2-4-iodophenyl-2-methylpropane,2-4'-iodophenyl-2-methylpropane,pubchem3974,4-t-butyl-iodobenzene
IUPAC Name 1-tert-butyl-4-iodobenzene
InChI Key WQVIVQDHNKQWTM-UHFFFAOYSA-N
Molecular Formula C10H13I
7,144

2-(4-Bromophenyl)-4,6-diphenyl-1,3,5-triazine 98.0+%, TCI America™
SDP

CAS: 23449-08-3 Molecular Formula: C21H14BrN3 Molecular Weight (g/mol): 388.27 MDL Number: MFCD00194632 InChI Key: AYHGAQGOMUQMTR-UHFFFAOYSA-N PubChem CID: 1728672 IUPAC Name: 2-(4-bromophenyl)-4,6-diphenyl-1,3,5-triazine SMILES: BrC1=CC=C(C=C1)C1=NC(=NC(=N1)C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 1728672
CAS 23449-08-3
Molecular Weight (g/mol) 388.27
MDL Number MFCD00194632
SMILES BrC1=CC=C(C=C1)C1=NC(=NC(=N1)C1=CC=CC=C1)C1=CC=CC=C1
IUPAC Name 2-(4-bromophenyl)-4,6-diphenyl-1,3,5-triazine
InChI Key AYHGAQGOMUQMTR-UHFFFAOYSA-N
Molecular Formula C21H14BrN3
7,145

2-(Trifluoromethyl)phenylacetic Acid 98.0+%, TCI America™
SDP

CAS: 3038-48-0 Molecular Formula: C9H6F3O2 Molecular Weight (g/mol): 203.14 MDL Number: MFCD00004327 InChI Key: TYOCDHCKTWANIR-UHFFFAOYSA-M Synonym: 2-trifluoromethyl phenylacetic acid,2-2-trifluoromethyl phenyl acetic acid,2-trifluoromethylphenylacetic acid,a,a,a-trifluoro-o-tolyl acetic acid,2-trifluoromethyl phenyl acetic acid,alpha,alpha,alpha-trifluoro-o-tolyl acetic acid,benzeneacetic acid, 2-trifluoromethyl,acmc-209hfg,ksc494k8b PubChem CID: 594597 IUPAC Name: 2-[2-(trifluoromethyl)phenyl]acetate SMILES: [O-]C(=O)CC1=CC=CC=C1C(F)(F)F

PubChem CID 594597
CAS 3038-48-0
Molecular Weight (g/mol) 203.14
MDL Number MFCD00004327
SMILES [O-]C(=O)CC1=CC=CC=C1C(F)(F)F
Synonym 2-trifluoromethyl phenylacetic acid,2-2-trifluoromethyl phenyl acetic acid,2-trifluoromethylphenylacetic acid,a,a,a-trifluoro-o-tolyl acetic acid,2-trifluoromethyl phenyl acetic acid,alpha,alpha,alpha-trifluoro-o-tolyl acetic acid,benzeneacetic acid, 2-trifluoromethyl,acmc-209hfg,ksc494k8b
IUPAC Name 2-[2-(trifluoromethyl)phenyl]acetate
InChI Key TYOCDHCKTWANIR-UHFFFAOYSA-M
Molecular Formula C9H6F3O2
7,146

4-(4-Chlorophenoxy)benzonitrile 98.0+%, TCI America™
SDP

CAS: 74448-92-3 Molecular Formula: C13H8ClNO Molecular Weight (g/mol): 229.663 InChI Key: SOTAPBLDXLHNRZ-UHFFFAOYSA-N Synonym: 4-Chloro-4′C-cyanodiphenyl Ether PubChem CID: 11195570 IUPAC Name: 4-(4-chlorophenoxy)benzonitrile SMILES: C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)Cl

PubChem CID 11195570
CAS 74448-92-3
Molecular Weight (g/mol) 229.663
SMILES C1=CC(=CC=C1C#N)OC2=CC=C(C=C2)Cl
Synonym 4-Chloro-4′C-cyanodiphenyl Ether
IUPAC Name 4-(4-chlorophenoxy)benzonitrile
InChI Key SOTAPBLDXLHNRZ-UHFFFAOYSA-N
Molecular Formula C13H8ClNO
7,147

3,4-Dimethoxybenzoic Acid 98.0+%, TCI America™
SDP

CAS: 93-07-2 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.175 MDL Number: MFCD00002500 InChI Key: DAUAQNGYDSHRET-UHFFFAOYSA-N Synonym: veratric acid,benzoic acid, 3,4-dimethoxy,dimethylprotocatechuic acid,veratrylic acid,3,4-dimethylprotocatechuic acid,veratrumenoic acid,3,4-dimethoxy-benzoic acid,unii-1yy04e7rr4,3,4-dimethoxybenzoes PubChem CID: 7121 ChEBI: CHEBI:296881 IUPAC Name: 3,4-dimethoxybenzoic acid SMILES: COC1=C(C=C(C=C1)C(=O)O)OC

PubChem CID 7121
CAS 93-07-2
Molecular Weight (g/mol) 182.175
ChEBI CHEBI:296881
MDL Number MFCD00002500
SMILES COC1=C(C=C(C=C1)C(=O)O)OC
Synonym veratric acid,benzoic acid, 3,4-dimethoxy,dimethylprotocatechuic acid,veratrylic acid,3,4-dimethylprotocatechuic acid,veratrumenoic acid,3,4-dimethoxy-benzoic acid,unii-1yy04e7rr4,3,4-dimethoxybenzoes
IUPAC Name 3,4-dimethoxybenzoic acid
InChI Key DAUAQNGYDSHRET-UHFFFAOYSA-N
Molecular Formula C9H10O4
7,148

Diveratryl Ether 98.0+%, TCI America™
SDP

CAS: 23702-54-7 Molecular Formula: C18H22O5 Molecular Weight (g/mol): 318.37 MDL Number: MFCD00025741 InChI Key: KTFBMMKWTQVUIV-UHFFFAOYSA-N Synonym: 3,4-Dimethoxybenzyl Ether, 3,3′C,4,4′C-Tetramethoxydibenzyl Ether, Veratryl Ether, Bis(3,4-dimethoxybenzyl) Ether PubChem CID: 285108 IUPAC Name: 4-{[(3,4-dimethoxyphenyl)methoxy]methyl}-1,2-dimethoxybenzene SMILES: COC1=CC=C(COCC2=CC=C(OC)C(OC)=C2)C=C1OC

PubChem CID 285108
CAS 23702-54-7
Molecular Weight (g/mol) 318.37
MDL Number MFCD00025741
SMILES COC1=CC=C(COCC2=CC=C(OC)C(OC)=C2)C=C1OC
Synonym 3,4-Dimethoxybenzyl Ether, 3,3′C,4,4′C-Tetramethoxydibenzyl Ether, Veratryl Ether, Bis(3,4-dimethoxybenzyl) Ether
IUPAC Name 4-{[(3,4-dimethoxyphenyl)methoxy]methyl}-1,2-dimethoxybenzene
InChI Key KTFBMMKWTQVUIV-UHFFFAOYSA-N
Molecular Formula C18H22O5
7,149

2-Fluorobenzoyl Chloride 98.0+%, TCI America™
SDP

CAS: 393-52-2 Molecular Formula: C7H4ClFO Molecular Weight (g/mol): 158.556 MDL Number: MFCD00000656 InChI Key: RAAGZOYMEQDCTD-UHFFFAOYSA-N Synonym: o-fluorobenzoyl chloride,benzoyl chloride, 2-fluoro,benzoyl chloride, o-fluoro,2-fluorobenzoylchloride,2-fluoro benzoyl chloride,unii-z4h017n76s,ccris 5914,fluorobenzoyl chloride,benzoyl chloride, fluoro,2-fluorobenzoic acid chloride PubChem CID: 9808 IUPAC Name: 2-fluorobenzoyl chloride SMILES: C1=CC=C(C(=C1)C(=O)Cl)F

PubChem CID 9808
CAS 393-52-2
Molecular Weight (g/mol) 158.556
MDL Number MFCD00000656
SMILES C1=CC=C(C(=C1)C(=O)Cl)F
Synonym o-fluorobenzoyl chloride,benzoyl chloride, 2-fluoro,benzoyl chloride, o-fluoro,2-fluorobenzoylchloride,2-fluoro benzoyl chloride,unii-z4h017n76s,ccris 5914,fluorobenzoyl chloride,benzoyl chloride, fluoro,2-fluorobenzoic acid chloride
IUPAC Name 2-fluorobenzoyl chloride
InChI Key RAAGZOYMEQDCTD-UHFFFAOYSA-N
Molecular Formula C7H4ClFO
7,150

9,9-Bis(4-hydroxy-3-methylphenyl)fluorene 98.0+%, TCI America™
SDP

CAS: 88938-12-9 Molecular Formula: C27H22O2 Molecular Weight (g/mol): 378.47 MDL Number: MFCD04038046 InChI Key: NUDSREQIJYWLRA-UHFFFAOYSA-N PubChem CID: 11014345 IUPAC Name: 4-[9-(4-hydroxy-3-methylphenyl)-9H-fluoren-9-yl]-2-methylphenol SMILES: CC1=C(O)C=CC(=C1)C1(C2=CC=CC=C2C2=CC=CC=C12)C1=CC(C)=C(O)C=C1

PubChem CID 11014345
CAS 88938-12-9
Molecular Weight (g/mol) 378.47
MDL Number MFCD04038046
SMILES CC1=C(O)C=CC(=C1)C1(C2=CC=CC=C2C2=CC=CC=C12)C1=CC(C)=C(O)C=C1
IUPAC Name 4-[9-(4-hydroxy-3-methylphenyl)-9H-fluoren-9-yl]-2-methylphenol
InChI Key NUDSREQIJYWLRA-UHFFFAOYSA-N
Molecular Formula C27H22O2
7,151

Phenoxyacetonitrile 98.0+%, TCI America™
SDP

CAS: 3598-14-9 Molecular Formula: C8H7NO Molecular Weight (g/mol): 133.15 MDL Number: MFCD00052017 InChI Key: VLLSCJFPVSQXDM-UHFFFAOYSA-N Synonym: phenoxyacetonitrile,acetonitrile, phenoxy,2-phenoxyethanenitrile,phenoxy-acetonitrile,2-phenoxy-acetonitrile,acmc-1ajch,acetonitrile,2-phenoxy PubChem CID: 241641 IUPAC Name: 2-phenoxyacetonitrile SMILES: N#CCOC1=CC=CC=C1

PubChem CID 241641
CAS 3598-14-9
Molecular Weight (g/mol) 133.15
MDL Number MFCD00052017
SMILES N#CCOC1=CC=CC=C1
Synonym phenoxyacetonitrile,acetonitrile, phenoxy,2-phenoxyethanenitrile,phenoxy-acetonitrile,2-phenoxy-acetonitrile,acmc-1ajch,acetonitrile,2-phenoxy
IUPAC Name 2-phenoxyacetonitrile
InChI Key VLLSCJFPVSQXDM-UHFFFAOYSA-N
Molecular Formula C8H7NO
7,152

p-Toluenesulfonyl Isocyanate 95.0+%, TCI America™
SDP

CAS: 4083-64-1 Molecular Formula: C8H7NO3S Molecular Weight (g/mol): 197.21 MDL Number: MFCD00002030 InChI Key: VLJQDHDVZJXNQL-UHFFFAOYSA-N Synonym: tosyl isocyanate,p-toluenesulfonyl isocyanate,4-methylbenzenesulfonyl isocyanate,p-toluenesulphonyl isocyanate,benzenesulfonyl isocyanate, 4-methyl,tosylisocyanate,p-tolylsulfonyl isocyanate,unii-h9004fjx6v,p-toluenesulfonic acid, anhydride with isocyanic acid,p-toluene sulfonyl isocyanate PubChem CID: 77703 IUPAC Name: 4-methylbenzene-1-sulfonyl isocyanate SMILES: CC1=CC=C(C=C1)S(=O)(=O)N=C=O

PubChem CID 77703
CAS 4083-64-1
Molecular Weight (g/mol) 197.21
MDL Number MFCD00002030
SMILES CC1=CC=C(C=C1)S(=O)(=O)N=C=O
Synonym tosyl isocyanate,p-toluenesulfonyl isocyanate,4-methylbenzenesulfonyl isocyanate,p-toluenesulphonyl isocyanate,benzenesulfonyl isocyanate, 4-methyl,tosylisocyanate,p-tolylsulfonyl isocyanate,unii-h9004fjx6v,p-toluenesulfonic acid, anhydride with isocyanic acid,p-toluene sulfonyl isocyanate
IUPAC Name 4-methylbenzene-1-sulfonyl isocyanate
InChI Key VLJQDHDVZJXNQL-UHFFFAOYSA-N
Molecular Formula C8H7NO3S
7,153

Phenyl Trifluoroacetate 96.0+%, TCI America™
SDP

CAS: 500-73-2 Molecular Formula: C8H5F3O2 Molecular Weight (g/mol): 190.121 MDL Number: MFCD00039232 InChI Key: DVCMYAIUSOSIQP-UHFFFAOYSA-N Synonym: phenyl trifluoroacetate,acetic acid, trifluoro-, phenyl ester,acetic acid, 2,2,2-trifluoro-, phenyl ester,trifluoroacetic acid phenyl ester,phenyltrifluoroacetate,acmc-209kjz,dvcmyaiusosiqp-uhfffaoysa PubChem CID: 68143 IUPAC Name: phenyl 2,2,2-trifluoroacetate SMILES: C1=CC=C(C=C1)OC(=O)C(F)(F)F

PubChem CID 68143
CAS 500-73-2
Molecular Weight (g/mol) 190.121
MDL Number MFCD00039232
SMILES C1=CC=C(C=C1)OC(=O)C(F)(F)F
Synonym phenyl trifluoroacetate,acetic acid, trifluoro-, phenyl ester,acetic acid, 2,2,2-trifluoro-, phenyl ester,trifluoroacetic acid phenyl ester,phenyltrifluoroacetate,acmc-209kjz,dvcmyaiusosiqp-uhfffaoysa
IUPAC Name phenyl 2,2,2-trifluoroacetate
InChI Key DVCMYAIUSOSIQP-UHFFFAOYSA-N
Molecular Formula C8H5F3O2
7,154

Tolylene-2,6-diisocyanate 98.0+%, TCI America™
SDP

CAS: 91-08-7 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.159 MDL Number: MFCD00002010 InChI Key: RUELTTOHQODFPA-UHFFFAOYSA-N Synonym: 2,6-diisocyanatotoluene,toluene-2,6-diisocyanate,2,6-toluene diisocyanate,2-methyl-m-phenylene diisocyanate,2,6-tdi,m-tolylene diisocyanate,meta-tolylene diisocyanate,toluene 2,6-diisocyanate,benzene, 1,3-diisocyanato-2-methyl,2,6-diisocyanato-1-methylbenzene PubChem CID: 7040 ChEBI: CHEBI:53557 IUPAC Name: 1,3-diisocyanato-2-methylbenzene SMILES: CC1=C(C=CC=C1N=C=O)N=C=O

PubChem CID 7040
CAS 91-08-7
Molecular Weight (g/mol) 174.159
ChEBI CHEBI:53557
MDL Number MFCD00002010
SMILES CC1=C(C=CC=C1N=C=O)N=C=O
Synonym 2,6-diisocyanatotoluene,toluene-2,6-diisocyanate,2,6-toluene diisocyanate,2-methyl-m-phenylene diisocyanate,2,6-tdi,m-tolylene diisocyanate,meta-tolylene diisocyanate,toluene 2,6-diisocyanate,benzene, 1,3-diisocyanato-2-methyl,2,6-diisocyanato-1-methylbenzene
IUPAC Name 1,3-diisocyanato-2-methylbenzene
InChI Key RUELTTOHQODFPA-UHFFFAOYSA-N
Molecular Formula C9H6N2O2
7,155

1,3,5-Trifluorobenzene 98.0+%, TCI America™
SDP

CAS: 372-38-3 Molecular Formula: C6H3F3 Molecular Weight (g/mol): 132.085 MDL Number: MFCD00000333 InChI Key: JXUKFFRPLNTYIV-UHFFFAOYSA-N Synonym: benzene, 1,3,5-trifluoro,sym-trifluorobenzene,unii-bn94c411f8,pubchem1069,1,5-trifluorobenzene,acmc-209iru,2,4,6-trifluorophenyl,benzene,3,5-trifluoro,1,3,5-tri-fluorobenzene,1,3,5-trifluoro-benzene PubChem CID: 9745 IUPAC Name: 1,3,5-trifluorobenzene SMILES: C1=C(C=C(C=C1F)F)F

PubChem CID 9745
CAS 372-38-3
Molecular Weight (g/mol) 132.085
MDL Number MFCD00000333
SMILES C1=C(C=C(C=C1F)F)F
Synonym benzene, 1,3,5-trifluoro,sym-trifluorobenzene,unii-bn94c411f8,pubchem1069,1,5-trifluorobenzene,acmc-209iru,2,4,6-trifluorophenyl,benzene,3,5-trifluoro,1,3,5-tri-fluorobenzene,1,3,5-trifluoro-benzene
IUPAC Name 1,3,5-trifluorobenzene
InChI Key JXUKFFRPLNTYIV-UHFFFAOYSA-N
Molecular Formula C6H3F3