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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 (88,065)
Phenols (17,839)
Naphthalenes (5,668)
Phenol esters (1,994)
Fluorenes (1,268)
Unsubstituted Phenols (1,237)
Thiophenols (635)
Anthracenes (494)
Indanes (401)
Phenanthrenes and derivatives (361)
Tetralins (336)
Triphenyl compounds (276)
Pyrenes (270)
Dibenzocycloheptenes (61)
Naphthacenes (37)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (16)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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10,006 – 10,020 of 105,714 results
10,006

(R)-(-)-1,2,3,4-Tetrahydro-1-naphthylamine 98.0+%, TCI America™

CAS: 23357-46-2 Molecular Formula: C10H13N Molecular Weight (g/mol): 147.221 MDL Number: MFCD00671629 InChI Key: JRZGPXSSNPTNMA-SNVBAGLBSA-N PubChem CID: 7058072 IUPAC Name: (1R)-1,2,3,4-tetrahydronaphthalen-1-amine SMILES: C1CC(C2=CC=CC=C2C1)N

PubChem CID 7058072
CAS 23357-46-2
Molecular Weight (g/mol) 147.221
MDL Number MFCD00671629
SMILES C1CC(C2=CC=CC=C2C1)N
IUPAC Name (1R)-1,2,3,4-tetrahydronaphthalen-1-amine
InChI Key JRZGPXSSNPTNMA-SNVBAGLBSA-N
Molecular Formula C10H13N
10,007

4,4'-Diiodo-3,3'-dimethylbiphenyl 98.0+%, TCI America™

CAS: 7583-27-9 Molecular Formula: C14H12I2 Molecular Weight (g/mol): 434.059 MDL Number: MFCD04038414 InChI Key: ISWXEMYZGWXIIZ-UHFFFAOYSA-N PubChem CID: 22323609 IUPAC Name: 1-iodo-4-(4-iodo-3-methylphenyl)-2-methylbenzene SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)I)C)I

PubChem CID 22323609
CAS 7583-27-9
Molecular Weight (g/mol) 434.059
MDL Number MFCD04038414
SMILES CC1=C(C=CC(=C1)C2=CC(=C(C=C2)I)C)I
IUPAC Name 1-iodo-4-(4-iodo-3-methylphenyl)-2-methylbenzene
InChI Key ISWXEMYZGWXIIZ-UHFFFAOYSA-N
Molecular Formula C14H12I2
10,008

2-Amino-3-methylbenzoic Acid 98.0+%, TCI America™

CAS: 4389-45-1 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 InChI Key: WNAJXPYVTFYEST-UHFFFAOYSA-N Synonym: 3-methylanthranilic acid,2-amino-3-methyl-benzoic acid,2-amino-3-methylbenzoicacid,3-methyl-2-aminobenzoic acid,benzoic acid, 2-amino-3-methyl,2-amino-m-toluic acid,2-amino-3-methyl benzoic acid,m-toluic acid, 2-amino,unii-8rgx6sqe9n,2-amino-3-methylbenzoate PubChem CID: 78101 ChEBI: CHEBI:80574 IUPAC Name: 2-amino-3-methylbenzoic acid SMILES: CC1=CC=CC(=C1N)C(=O)O

PubChem CID 78101
CAS 4389-45-1
Molecular Weight (g/mol) 151.165
ChEBI CHEBI:80574
SMILES CC1=CC=CC(=C1N)C(=O)O
Synonym 3-methylanthranilic acid,2-amino-3-methyl-benzoic acid,2-amino-3-methylbenzoicacid,3-methyl-2-aminobenzoic acid,benzoic acid, 2-amino-3-methyl,2-amino-m-toluic acid,2-amino-3-methyl benzoic acid,m-toluic acid, 2-amino,unii-8rgx6sqe9n,2-amino-3-methylbenzoate
IUPAC Name 2-amino-3-methylbenzoic acid
InChI Key WNAJXPYVTFYEST-UHFFFAOYSA-N
Molecular Formula C8H9NO2
10,009

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

CAS: 1073-72-9 Molecular Formula: C7H8OS Molecular Weight (g/mol): 140.20 MDL Number: MFCD00002351 InChI Key: QASBCTGZKABPKX-UHFFFAOYSA-N Synonym: 4-methylthio phenol,4-methylmercapto phenol,phenol, 4-methylthio,p-methylthio phenol,4-hydroxythioanisole,4-methylmercaptophenol,p-hydroxythioanisole,4-methylsulfanyl phenol,phenol, p-methylthio,p-hydroxyphenyl methyl sulfide PubChem CID: 14086 ChEBI: CHEBI:38862 IUPAC Name: 4-(methylsulfanyl)phenol SMILES: CSC1=CC=C(O)C=C1

PubChem CID 14086
CAS 1073-72-9
Molecular Weight (g/mol) 140.20
ChEBI CHEBI:38862
MDL Number MFCD00002351
SMILES CSC1=CC=C(O)C=C1
Synonym 4-methylthio phenol,4-methylmercapto phenol,phenol, 4-methylthio,p-methylthio phenol,4-hydroxythioanisole,4-methylmercaptophenol,p-hydroxythioanisole,4-methylsulfanyl phenol,phenol, p-methylthio,p-hydroxyphenyl methyl sulfide
IUPAC Name 4-(methylsulfanyl)phenol
InChI Key QASBCTGZKABPKX-UHFFFAOYSA-N
Molecular Formula C7H8OS
10,010

2,3,6-Trifluorobenzoic Acid 98.0+%, TCI America™

CAS: 2358-29-4 Molecular Formula: C7H2F3O2 Molecular Weight (g/mol): 175.09 MDL Number: MFCD00002409 InChI Key: MGUPHQGQNHDGNK-UHFFFAOYSA-M Synonym: 2,5,6-trifluorobenzoic acid,2,3,6-trifluorobenzoicacid,2,3,6-trifluoro-benzoic acid,benzoic acid, 2,3,6-trifluoro,pubchem1344,intermediates-zcf02628,ksc494k2n,2,3,6-trifluoro benzoic acid,rarechem al bo 0267,2,3,6-trifluorobenzoic acid PubChem CID: 520062 IUPAC Name: 2,3,6-trifluorobenzoate SMILES: [O-]C(=O)C1=C(F)C=CC(F)=C1F

PubChem CID 520062
CAS 2358-29-4
Molecular Weight (g/mol) 175.09
MDL Number MFCD00002409
SMILES [O-]C(=O)C1=C(F)C=CC(F)=C1F
Synonym 2,5,6-trifluorobenzoic acid,2,3,6-trifluorobenzoicacid,2,3,6-trifluoro-benzoic acid,benzoic acid, 2,3,6-trifluoro,pubchem1344,intermediates-zcf02628,ksc494k2n,2,3,6-trifluoro benzoic acid,rarechem al bo 0267,2,3,6-trifluorobenzoic acid
IUPAC Name 2,3,6-trifluorobenzoate
InChI Key MGUPHQGQNHDGNK-UHFFFAOYSA-M
Molecular Formula C7H2F3O2
10,011

2-Chloro-5-nitrobenzoyl Chloride 98.0+%, TCI America™

CAS: 25784-91-2 Molecular Formula: C7H3Cl2NO3 Molecular Weight (g/mol): 220.005 MDL Number: MFCD00059180 InChI Key: OGLKKYALUKXVPQ-UHFFFAOYSA-N Synonym: 2-chloro-5-nitrobenzoylchloride,benzoyl chloride, 2-chloro-5-nitro,acmc-1cq6z,2-chloro-5nitrobenzoyl chloride,2-chloro-5-nitro-benzoylchlorid,2-chloro-5-nitro-benzoic chloride,2-chloro-5-nitro-benzoyl chloride,benzoyl chloride,2-chloro-5-nitro,2-chloranyl-5-nitro-benzoyl chloride,2-chloro-5-nitrobenzoic acid chloride PubChem CID: 117637 IUPAC Name: 2-chloro-5-nitrobenzoyl chloride SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(=O)Cl)Cl

PubChem CID 117637
CAS 25784-91-2
Molecular Weight (g/mol) 220.005
MDL Number MFCD00059180
SMILES C1=CC(=C(C=C1[N+](=O)[O-])C(=O)Cl)Cl
Synonym 2-chloro-5-nitrobenzoylchloride,benzoyl chloride, 2-chloro-5-nitro,acmc-1cq6z,2-chloro-5nitrobenzoyl chloride,2-chloro-5-nitro-benzoylchlorid,2-chloro-5-nitro-benzoic chloride,2-chloro-5-nitro-benzoyl chloride,benzoyl chloride,2-chloro-5-nitro,2-chloranyl-5-nitro-benzoyl chloride,2-chloro-5-nitrobenzoic acid chloride
IUPAC Name 2-chloro-5-nitrobenzoyl chloride
InChI Key OGLKKYALUKXVPQ-UHFFFAOYSA-N
Molecular Formula C7H3Cl2NO3
10,012

3,4-Difluorobenzotrifluoride 97.0+%, TCI America™

CAS: 32137-19-2 Molecular Formula: C7H3F5 Molecular Weight (g/mol): 182.09 MDL Number: MFCD00077510 InChI Key: MVCGQTYWLZSKSB-UHFFFAOYSA-N Synonym: 3,4-difluorobenzotrifluoride,1,2-difluoro-4-trifluoromethyl benzene,alpha,alpha,alpha,3,4-pentafluorotoluene,benzene, 1,2-difluoro-4-trifluoromethyl,pubchem1651,ksc497k4r,1,2-difluoro-4-trifluoromethyl benzene # PubChem CID: 602797 IUPAC Name: 1,2-difluoro-4-(trifluoromethyl)benzene SMILES: FC1=CC=C(C=C1F)C(F)(F)F

PubChem CID 602797
CAS 32137-19-2
Molecular Weight (g/mol) 182.09
MDL Number MFCD00077510
SMILES FC1=CC=C(C=C1F)C(F)(F)F
Synonym 3,4-difluorobenzotrifluoride,1,2-difluoro-4-trifluoromethyl benzene,alpha,alpha,alpha,3,4-pentafluorotoluene,benzene, 1,2-difluoro-4-trifluoromethyl,pubchem1651,ksc497k4r,1,2-difluoro-4-trifluoromethyl benzene #
IUPAC Name 1,2-difluoro-4-(trifluoromethyl)benzene
InChI Key MVCGQTYWLZSKSB-UHFFFAOYSA-N
Molecular Formula C7H3F5
10,013

2,3,4-Trifluoroaniline 98.0+%, TCI America™

CAS: 3862-73-5 Molecular Formula: C6H4F3N Molecular Weight (g/mol): 147.1 MDL Number: MFCD00011737 InChI Key: WRDGNXCXTDDYBZ-UHFFFAOYSA-N Synonym: 2,3,4-trifluorobenzenamine,benzenamine, 2,3,4-trifluoro,2,3,4-trifluoraniline,2,3,4-trifluoro-phenylamine,aniline, 2,3,4-trifluoro,2,3,4-trifluoro aniline,2,3,4-trifluorophenylamine,pubchem2297,acmc-1clgf,2.3.4-trifluoroaniline PubChem CID: 77468 IUPAC Name: 2,3,4-trifluoroaniline SMILES: C1=CC(=C(C(=C1N)F)F)F

PubChem CID 77468
CAS 3862-73-5
Molecular Weight (g/mol) 147.1
MDL Number MFCD00011737
SMILES C1=CC(=C(C(=C1N)F)F)F
Synonym 2,3,4-trifluorobenzenamine,benzenamine, 2,3,4-trifluoro,2,3,4-trifluoraniline,2,3,4-trifluoro-phenylamine,aniline, 2,3,4-trifluoro,2,3,4-trifluoro aniline,2,3,4-trifluorophenylamine,pubchem2297,acmc-1clgf,2.3.4-trifluoroaniline
IUPAC Name 2,3,4-trifluoroaniline
InChI Key WRDGNXCXTDDYBZ-UHFFFAOYSA-N
Molecular Formula C6H4F3N
10,014

trans-4-Nitrostilbene 98.0+%, TCI America™

CAS: 1694-20-8 Molecular Formula: C14H11NO2 Molecular Weight (g/mol): 225.247 MDL Number: MFCD00053614 InChI Key: ZISCOWXWCHUSMH-VOTSOKGWSA-N PubChem CID: 639659 ChEBI: CHEBI:377106 IUPAC Name: 1-nitro-4-[(E)-2-phenylethenyl]benzene SMILES: C1=CC=C(C=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-]

PubChem CID 639659
CAS 1694-20-8
Molecular Weight (g/mol) 225.247
ChEBI CHEBI:377106
MDL Number MFCD00053614
SMILES C1=CC=C(C=C1)C=CC2=CC=C(C=C2)[N+](=O)[O-]
IUPAC Name 1-nitro-4-[(E)-2-phenylethenyl]benzene
InChI Key ZISCOWXWCHUSMH-VOTSOKGWSA-N
Molecular Formula C14H11NO2
10,015

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

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
10,016

2,2'-Methylenebis(6-bromo-4-chlorophenol) 95.0+%, TCI America™

CAS: 15435-29-7 Molecular Formula: C13H8Br2Cl2O2 Molecular Weight (g/mol): 426.91 MDL Number: MFCD00152965 InChI Key: TYBHZVUFOINFDV-UHFFFAOYSA-N Synonym: Bis(3-bromo-5-chloro-2-hydroxyphenyl)methane, 3,3′C-Dibromo-5,5′C-dichloro-2,2′C-dihydroxydiphenylmethane, Bromochlorophen PubChem CID: 84907 IUPAC Name: 2-bromo-6-[(3-bromo-5-chloro-2-hydroxyphenyl)methyl]-4-chlorophenol SMILES: OC1=C(Br)C=C(Cl)C=C1CC1=CC(Cl)=CC(Br)=C1O

PubChem CID 84907
CAS 15435-29-7
Molecular Weight (g/mol) 426.91
MDL Number MFCD00152965
SMILES OC1=C(Br)C=C(Cl)C=C1CC1=CC(Cl)=CC(Br)=C1O
Synonym Bis(3-bromo-5-chloro-2-hydroxyphenyl)methane, 3,3′C-Dibromo-5,5′C-dichloro-2,2′C-dihydroxydiphenylmethane, Bromochlorophen
IUPAC Name 2-bromo-6-[(3-bromo-5-chloro-2-hydroxyphenyl)methyl]-4-chlorophenol
InChI Key TYBHZVUFOINFDV-UHFFFAOYSA-N
Molecular Formula C13H8Br2Cl2O2
10,017

2,2'-Methylenebis(4-methylphenol) 90.0+%, TCI America™

CAS: 3236-63-3 Molecular Formula: C15H16O2 Molecular Weight (g/mol): 228.29 MDL Number: MFCD00155176 InChI Key: XZXYQEHISUMZAT-UHFFFAOYSA-N PubChem CID: 76715 IUPAC Name: 2-[(2-hydroxy-5-methylphenyl)methyl]-4-methylphenol SMILES: CC1=CC=C(O)C(CC2=CC(C)=CC=C2O)=C1

PubChem CID 76715
CAS 3236-63-3
Molecular Weight (g/mol) 228.29
MDL Number MFCD00155176
SMILES CC1=CC=C(O)C(CC2=CC(C)=CC=C2O)=C1
IUPAC Name 2-[(2-hydroxy-5-methylphenyl)methyl]-4-methylphenol
InChI Key XZXYQEHISUMZAT-UHFFFAOYSA-N
Molecular Formula C15H16O2
10,018

alpha-Chloro-m-xylene 97.0+%, TCI America™

CAS: 620-19-9 Molecular Formula: C8H9Cl Molecular Weight (g/mol): 140.61 MDL Number: MFCD00000909 InChI Key: LZBOHNCMCCSTJX-UHFFFAOYSA-N Synonym: 3-methylbenzyl chloride,1-chloromethyl-3-methylbenzene,m-xylyl chloride,3-methylbenzylchloride,alpha-chloro-m-xylene,m-methylbenzyl chloride,1-chloromethyl-3-methyl-benzene,m-chloromethyl toluene,3-chloromethyl toluene,benzene, 1-chloromethyl-3-methyl PubChem CID: 12102 IUPAC Name: 1-(chloromethyl)-3-methylbenzene SMILES: CC1=CC(=CC=C1)CCl

PubChem CID 12102
CAS 620-19-9
Molecular Weight (g/mol) 140.61
MDL Number MFCD00000909
SMILES CC1=CC(=CC=C1)CCl
Synonym 3-methylbenzyl chloride,1-chloromethyl-3-methylbenzene,m-xylyl chloride,3-methylbenzylchloride,alpha-chloro-m-xylene,m-methylbenzyl chloride,1-chloromethyl-3-methyl-benzene,m-chloromethyl toluene,3-chloromethyl toluene,benzene, 1-chloromethyl-3-methyl
IUPAC Name 1-(chloromethyl)-3-methylbenzene
InChI Key LZBOHNCMCCSTJX-UHFFFAOYSA-N
Molecular Formula C8H9Cl
10,019

3,5-Dimethylbenzaldehyde 96.0+%, TCI America™

CAS: 5779-95-3 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.178 MDL Number: MFCD00082777 InChI Key: NBEFMISJJNGCIZ-UHFFFAOYSA-N Synonym: benzaldehyde, 3,5-dimethyl,3,5-dimethyl benzaldehyde,m-xylene-5-carboxaldehyde,3,5-dimethyl-benzaldehyde,pubchem15515,acmc-1arkp,3,5-dimehtylbenzaldehyde,#,ksc494c0b,3,5-dimethylbenzaldehyde PubChem CID: 34225 IUPAC Name: 3,5-dimethylbenzaldehyde SMILES: CC1=CC(=CC(=C1)C=O)C

PubChem CID 34225
CAS 5779-95-3
Molecular Weight (g/mol) 134.178
MDL Number MFCD00082777
SMILES CC1=CC(=CC(=C1)C=O)C
Synonym benzaldehyde, 3,5-dimethyl,3,5-dimethyl benzaldehyde,m-xylene-5-carboxaldehyde,3,5-dimethyl-benzaldehyde,pubchem15515,acmc-1arkp,3,5-dimehtylbenzaldehyde,#,ksc494c0b,3,5-dimethylbenzaldehyde
IUPAC Name 3,5-dimethylbenzaldehyde
InChI Key NBEFMISJJNGCIZ-UHFFFAOYSA-N
Molecular Formula C9H10O
10,020

2,4-Dichlorobenzoyl Chloride 97.0+%, TCI America™

CAS: 89-75-8 Molecular Formula: C7H3Cl3O Molecular Weight (g/mol): 209.45 MDL Number: MFCD00000661 InChI Key: CEOCVKWBUWKBKA-UHFFFAOYSA-N Synonym: benzoyl chloride, 2,4-dichloro,2,4-dichlorobenzoylchloride,benzoylchloride, 2,4-dichloro,ccris 8616,acmc-1cuf7,dsstox_cid_31176,dsstox_gsid_52603,2,4-dichloro benzoylchloride,2.4-dichlorobenzoyl chloride,ksc450c2p PubChem CID: 66645 IUPAC Name: 2,4-dichlorobenzoyl chloride SMILES: ClC(=O)C1=CC=C(Cl)C=C1Cl

PubChem CID 66645
CAS 89-75-8
Molecular Weight (g/mol) 209.45
MDL Number MFCD00000661
SMILES ClC(=O)C1=CC=C(Cl)C=C1Cl
Synonym benzoyl chloride, 2,4-dichloro,2,4-dichlorobenzoylchloride,benzoylchloride, 2,4-dichloro,ccris 8616,acmc-1cuf7,dsstox_cid_31176,dsstox_gsid_52603,2,4-dichloro benzoylchloride,2.4-dichlorobenzoyl chloride,ksc450c2p
IUPAC Name 2,4-dichlorobenzoyl chloride
InChI Key CEOCVKWBUWKBKA-UHFFFAOYSA-N
Molecular Formula C7H3Cl3O