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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 (67,607)
Phenols (13,420)
Naphthalenes (5,064)
Fluorenes (1,235)
Unsubstituted Phenols (1,165)
Thiophenols (617)
Phenol esters (557)
Anthracenes (412)
Phenanthrenes and derivatives (327)
Tetralins (327)
Indanes (313)
Triphenyl compounds (277)
Pyrenes (229)
Dibenzocycloheptenes (62)
Naphthacenes (36)
Ellagic acids and derivatives (33)
Pentacenes (19)
Pentacenequinones (16)
Acenaphthylenes (15)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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1,066 – 1,080 of 78,418 results
1,066

Ethyl 4-methoxyphenylacetate, 97%

CAS: 14062-18-1 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00040760 InChI Key: DOCCDOCIYYDLGJ-UHFFFAOYSA-N Synonym: ethyl 2-4-methoxyphenyl acetate,ethyl 4-methoxyphenylacetate,4-methoxyphenylacetic acid ethyl ester,benzeneacetic acid, 4-methoxy-, ethyl ester,ethyl p-methoxyphenylacetate,ethyl 4-methoxyphenyl acetate,4-methoxy-phenyl-acetic acid ethyl ester,acmc-1bnx2,homoanisic acid ethyl ester PubChem CID: 84174 IUPAC Name: ethyl 2-(4-methoxyphenyl)acetate SMILES: CCOC(=O)CC1=CC=C(C=C1)OC

PubChem CID 84174
CAS 14062-18-1
Molecular Weight (g/mol) 194.23
MDL Number MFCD00040760
SMILES CCOC(=O)CC1=CC=C(C=C1)OC
Synonym ethyl 2-4-methoxyphenyl acetate,ethyl 4-methoxyphenylacetate,4-methoxyphenylacetic acid ethyl ester,benzeneacetic acid, 4-methoxy-, ethyl ester,ethyl p-methoxyphenylacetate,ethyl 4-methoxyphenyl acetate,4-methoxy-phenyl-acetic acid ethyl ester,acmc-1bnx2,homoanisic acid ethyl ester
IUPAC Name ethyl 2-(4-methoxyphenyl)acetate
InChI Key DOCCDOCIYYDLGJ-UHFFFAOYSA-N
Molecular Formula C11H14O3
1,067

(R)-(-)-alpha-Methoxy-alpha-(trifluoromethyl)phenylacetyl chloride, 98+%

CAS: 39637-99-5 Molecular Formula: C10H8ClF3O2 Molecular Weight (g/mol): 252.62 MDL Number: MFCD00044400 InChI Key: PAORVUMOXXAMPL-VIFPVBQESA-N Synonym: unii-81ut10uhv3,r---mtpa-cl,--alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,2r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,r---a-methoxy-a-trifluoromethylphenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,--mtpa-cl,--mosher's acid chloride PubChem CID: 3080792 IUPAC Name: (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride SMILES: CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F

PubChem CID 3080792
CAS 39637-99-5
Molecular Weight (g/mol) 252.62
MDL Number MFCD00044400
SMILES CO[C@](C(Cl)=O)(C1=CC=CC=C1)C(F)(F)F
Synonym unii-81ut10uhv3,r---mtpa-cl,--alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethyl phenylacetyl chloride,r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,2r-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride,r---a-methoxy-a-trifluoromethylphenylacetyl chloride,r---alpha-methoxy-alpha-trifluoromethylphenylacetyl chloride,--mtpa-cl,--mosher's acid chloride
IUPAC Name (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoyl chloride
InChI Key PAORVUMOXXAMPL-VIFPVBQESA-N
Molecular Formula C10H8ClF3O2
1,068

N-Phenylmethanesulfonamide, 98%, Thermo Scientific™

CAS: 1197-22-4 Molecular Formula: C7H9NO2S Molecular Weight (g/mol): 171.21 MDL Number: MFCD00043782 InChI Key: LBTPIFQNEKOAIM-UHFFFAOYSA-N Synonym: methanesulfonamide, n-phenyl,methanesulfonanilide,methanesulfanilide,mesylaniline,n-mesylaniline,n-methylsulphonylaniline,n-phenyl-methanesulfonamide,methylsulfonyl phenylamine,mesylanilide,methylsulfonyl aniline PubChem CID: 70970 IUPAC Name: N-phenylmethanesulfonamide SMILES: CS(=O)(=O)NC1=CC=CC=C1

PubChem CID 70970
CAS 1197-22-4
Molecular Weight (g/mol) 171.21
MDL Number MFCD00043782
SMILES CS(=O)(=O)NC1=CC=CC=C1
Synonym methanesulfonamide, n-phenyl,methanesulfonanilide,methanesulfanilide,mesylaniline,n-mesylaniline,n-methylsulphonylaniline,n-phenyl-methanesulfonamide,methylsulfonyl phenylamine,mesylanilide,methylsulfonyl aniline
IUPAC Name N-phenylmethanesulfonamide
InChI Key LBTPIFQNEKOAIM-UHFFFAOYSA-N
Molecular Formula C7H9NO2S
1,069

Benzyl 2-bromoethyl ether, 97%

CAS: 1462-37-9 Molecular Formula: C9H11BrO Molecular Weight (g/mol): 215.09 MDL Number: MFCD01321307 InChI Key: FWOHDAGPWDEWIB-UHFFFAOYSA-N Synonym: benzyl 2-bromoethyl ether,2-bromoethoxy methyl benzene,2-benzyloxy-1-bromoethane,benzyloxyethyl bromide,benzene, 2-bromoethoxy methyl,1-bromo-2-benzyloxyethane,2-bromoethoxymethyl benzene,2-bromo-ethoxymethyl-benzene PubChem CID: 73833 IUPAC Name: 2-bromoethoxymethylbenzene SMILES: C1=CC=C(C=C1)COCCBr

PubChem CID 73833
CAS 1462-37-9
Molecular Weight (g/mol) 215.09
MDL Number MFCD01321307
SMILES C1=CC=C(C=C1)COCCBr
Synonym benzyl 2-bromoethyl ether,2-bromoethoxy methyl benzene,2-benzyloxy-1-bromoethane,benzyloxyethyl bromide,benzene, 2-bromoethoxy methyl,1-bromo-2-benzyloxyethane,2-bromoethoxymethyl benzene,2-bromo-ethoxymethyl-benzene
IUPAC Name 2-bromoethoxymethylbenzene
InChI Key FWOHDAGPWDEWIB-UHFFFAOYSA-N
Molecular Formula C9H11BrO
1,070

alpha,alpha-Dimethylphenylacetic acid

CAS: 826-55-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00014332 InChI Key: YYEROYLAYAVZNW-UHFFFAOYSA-N Synonym: 2-methyl-2-phenylpropionic acid,2-phenylisobutyric acid,alpha,alpha-dimethylphenylacetic acid,unii-dr8huh2gyk,dimethylphenylacetic acid,dr8huh2gyk,2-methyl-2-phenyl-propionic acid,hydratropic acid, .alpha.-methyl,benzeneacetic acid,.alpha.-dimethyl,propionic acid, 2-methyl-2-phenyl PubChem CID: 13222 IUPAC Name: 2-methyl-2-phenylpropanoic acid SMILES: CC(C)(C(O)=O)C1=CC=CC=C1

PubChem CID 13222
CAS 826-55-1
Molecular Weight (g/mol) 164.20
MDL Number MFCD00014332
SMILES CC(C)(C(O)=O)C1=CC=CC=C1
Synonym 2-methyl-2-phenylpropionic acid,2-phenylisobutyric acid,alpha,alpha-dimethylphenylacetic acid,unii-dr8huh2gyk,dimethylphenylacetic acid,dr8huh2gyk,2-methyl-2-phenyl-propionic acid,hydratropic acid, .alpha.-methyl,benzeneacetic acid,.alpha.-dimethyl,propionic acid, 2-methyl-2-phenyl
IUPAC Name 2-methyl-2-phenylpropanoic acid
InChI Key YYEROYLAYAVZNW-UHFFFAOYSA-N
Molecular Formula C10H12O2
1,071

4-Hydroxy-3-nitrophenylacetic acid, 99%, Thermo Scientific™

CAS: 10463-20-4 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.15 InChI Key: QBHBHOSRLDPIHG-UHFFFAOYSA-N Synonym: 4-hydroxy-3-nitrophenylacetic acid,2-4-hydroxy-3-nitrophenyl acetic acid,4-hydroxy-3-nitrophenyl acetic acid,3-nitro-4-hydroxyphenylacetic acid,3-nitro-4-hydroxy phenylacetic acid,benzeneacetic acid, 4-hydroxy-3-nitro,no2hpa,hydroxynitrophenylaceticacid,acmc-2098cj,epitope id:158629 PubChem CID: 447364 ChEBI: CHEBI:546274 SMILES: C1=CC(=C(C=C1CC(=O)O)[N+](=O)[O-])O

PubChem CID 447364
CAS 10463-20-4
Molecular Weight (g/mol) 197.15
ChEBI CHEBI:546274
SMILES C1=CC(=C(C=C1CC(=O)O)[N+](=O)[O-])O
Synonym 4-hydroxy-3-nitrophenylacetic acid,2-4-hydroxy-3-nitrophenyl acetic acid,4-hydroxy-3-nitrophenyl acetic acid,3-nitro-4-hydroxyphenylacetic acid,3-nitro-4-hydroxy phenylacetic acid,benzeneacetic acid, 4-hydroxy-3-nitro,no2hpa,hydroxynitrophenylaceticacid,acmc-2098cj,epitope id:158629
InChI Key QBHBHOSRLDPIHG-UHFFFAOYSA-N
Molecular Formula C8H7NO5
1,072

1,8,9-Trihydroxyanthracene, 97%

CAS: 1143-38-0 Molecular Formula: C14H10O3 Molecular Weight (g/mol): 226.23 MDL Number: MFCD00053409 InChI Key: NUZWLKWWNNJHPT-UHFFFAOYSA-N Synonym: anthralin,dithranol,1,8-dihydroxyanthrone,1,8-dihydroxy-9-anthrone,chrysodermol,cigthranol,batridol,cignolin,psoriacid-stift,9 10h-anthracenone, 1,8-dihydroxy PubChem CID: 2202 ChEBI: CHEBI:37510 IUPAC Name: 1,8-dihydroxy-10H-anthracen-9-one SMILES: OC1=CC=CC2=C1C(=O)C1=C(O)C=CC=C1C2

PubChem CID 2202
CAS 1143-38-0
Molecular Weight (g/mol) 226.23
ChEBI CHEBI:37510
MDL Number MFCD00053409
SMILES OC1=CC=CC2=C1C(=O)C1=C(O)C=CC=C1C2
Synonym anthralin,dithranol,1,8-dihydroxyanthrone,1,8-dihydroxy-9-anthrone,chrysodermol,cigthranol,batridol,cignolin,psoriacid-stift,9 10h-anthracenone, 1,8-dihydroxy
IUPAC Name 1,8-dihydroxy-10H-anthracen-9-one
InChI Key NUZWLKWWNNJHPT-UHFFFAOYSA-N
Molecular Formula C14H10O3
1,073

4-Methoxybenzyl mercaptan, 98%

CAS: 6258-60-2 Molecular Formula: C8H10OS Molecular Weight (g/mol): 154.23 MDL Number: MFCD00004871 InChI Key: PTDVPWWJRCOIIO-UHFFFAOYSA-N Synonym: 4-methoxybenzyl mercaptan,4-methoxy-alpha-toluenethiol,4-methoxybenzylmercaptan,4-methoxyphenyl methanethiol,4-methoxy benzylmercaptan,4-methoxybenzenemethanethiol,benzenemethanethiol, 4-methoxy,p-methoxybenzyl mercaptan,p-methoxybenzylthiol,p-methoxybenzylmercaptan PubChem CID: 80407 IUPAC Name: (4-methoxyphenyl)methanethiol SMILES: COC1=CC=C(CS)C=C1

PubChem CID 80407
CAS 6258-60-2
Molecular Weight (g/mol) 154.23
MDL Number MFCD00004871
SMILES COC1=CC=C(CS)C=C1
Synonym 4-methoxybenzyl mercaptan,4-methoxy-alpha-toluenethiol,4-methoxybenzylmercaptan,4-methoxyphenyl methanethiol,4-methoxy benzylmercaptan,4-methoxybenzenemethanethiol,benzenemethanethiol, 4-methoxy,p-methoxybenzyl mercaptan,p-methoxybenzylthiol,p-methoxybenzylmercaptan
IUPAC Name (4-methoxyphenyl)methanethiol
InChI Key PTDVPWWJRCOIIO-UHFFFAOYSA-N
Molecular Formula C8H10OS
1,074

Butylated Hydroxyanisole, 98.5%, MP Biomedicals™

CAS: 25013-16-5 Molecular Formula: C11H16O2 Molecular Weight (g/mol): 180.247 InChI Key: MRBKEAMVRSLQPH-UHFFFAOYSA-N Synonym: 3-tert-butyl-4-hydroxyanisole,4-hydroxy-3-tert-butylanisole,2-tert-butyl-4-methoxyphenol,3-bha,4-methoxy-2-tert-butylphenol,3-t-butyl-4-hydroxyanisole,phenol, 2-1,1-dimethylethyl-4-methoxy,2-1,1-dimethylethyl-4-methoxyphenol,2-butyl-4-hydroxyanisole,phenol, 2-tert-butyl-4-methoxy PubChem CID: 8456 ChEBI: CHEBI:76358 IUPAC Name: 2-tert-butyl-4-methoxyphenol SMILES: CC(C)(C)C1=C(C=CC(=C1)OC)O

PubChem CID 8456
CAS 25013-16-5
Molecular Weight (g/mol) 180.247
ChEBI CHEBI:76358
SMILES CC(C)(C)C1=C(C=CC(=C1)OC)O
Synonym 3-tert-butyl-4-hydroxyanisole,4-hydroxy-3-tert-butylanisole,2-tert-butyl-4-methoxyphenol,3-bha,4-methoxy-2-tert-butylphenol,3-t-butyl-4-hydroxyanisole,phenol, 2-1,1-dimethylethyl-4-methoxy,2-1,1-dimethylethyl-4-methoxyphenol,2-butyl-4-hydroxyanisole,phenol, 2-tert-butyl-4-methoxy
IUPAC Name 2-tert-butyl-4-methoxyphenol
InChI Key MRBKEAMVRSLQPH-UHFFFAOYSA-N
Molecular Formula C11H16O2
1,075

Tris(pentafluorophenyl)phosphine, 95%

CAS: 1259-35-4 Molecular Formula: C18F15P Molecular Weight (g/mol): 532.15 MDL Number: MFCD00079654 InChI Key: FQLSDFNKTNBQLC-UHFFFAOYSA-N Synonym: tris pentafluorophenyl phosphine,phosphine, tris pentafluorophenyl,tris perfluorophenyl phosphine,tris pentafluorophenyl phosphane,tris 2,3,4,5,6-pentafluorophenyl phosphane,pubchem6422,acmc-1bogg,ksc491k1f,tris-pentafluorophenyl-phosphane PubChem CID: 102076 IUPAC Name: tris(2,3,4,5,6-pentafluorophenyl)phosphane SMILES: FC1=C(F)C(F)=C(P(C2=C(F)C(F)=C(F)C(F)=C2F)C2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1F

PubChem CID 102076
CAS 1259-35-4
Molecular Weight (g/mol) 532.15
MDL Number MFCD00079654
SMILES FC1=C(F)C(F)=C(P(C2=C(F)C(F)=C(F)C(F)=C2F)C2=C(F)C(F)=C(F)C(F)=C2F)C(F)=C1F
Synonym tris pentafluorophenyl phosphine,phosphine, tris pentafluorophenyl,tris perfluorophenyl phosphine,tris pentafluorophenyl phosphane,tris 2,3,4,5,6-pentafluorophenyl phosphane,pubchem6422,acmc-1bogg,ksc491k1f,tris-pentafluorophenyl-phosphane
IUPAC Name tris(2,3,4,5,6-pentafluorophenyl)phosphane
InChI Key FQLSDFNKTNBQLC-UHFFFAOYSA-N
Molecular Formula C18F15P
1,076

4-Fluoro-2-methylbenzyl alcohol, 99%

CAS: 80141-91-9 Molecular Formula: C8H9FO Molecular Weight (g/mol): 140.157 MDL Number: MFCD03701058 InChI Key: YSULUXOLTMBSFF-UHFFFAOYSA-N Synonym: 4-fluoro-2-methylphenyl methanol,4-fluoro-2-methylbenzyl alcohol,4-fluoro-2-methylbenzylalcohol,rarechem al bd 0506,4-fluoro-2-methylbenzenemethanol,benzenemethanol, 4-fluoro-2-methyl,4-fluoro-2-methyl-phenyl-methanol,4-fluoro-2-methylphenyl methan-1-ol,4'-fluoro-2-methylbenzyl alcohol PubChem CID: 3872017 IUPAC Name: (4-fluoro-2-methylphenyl)methanol SMILES: CC1=C(C=CC(=C1)F)CO

PubChem CID 3872017
CAS 80141-91-9
Molecular Weight (g/mol) 140.157
MDL Number MFCD03701058
SMILES CC1=C(C=CC(=C1)F)CO
Synonym 4-fluoro-2-methylphenyl methanol,4-fluoro-2-methylbenzyl alcohol,4-fluoro-2-methylbenzylalcohol,rarechem al bd 0506,4-fluoro-2-methylbenzenemethanol,benzenemethanol, 4-fluoro-2-methyl,4-fluoro-2-methyl-phenyl-methanol,4-fluoro-2-methylphenyl methan-1-ol,4'-fluoro-2-methylbenzyl alcohol
IUPAC Name (4-fluoro-2-methylphenyl)methanol
InChI Key YSULUXOLTMBSFF-UHFFFAOYSA-N
Molecular Formula C8H9FO
1,077

1-Bromo-3-fluorobenzene, 99%

CAS: 1073-06-9 Molecular Formula: C6H4BrF MDL Number: MFCD00000326 InChI Key: QDFKKJYEIFBEFC-UHFFFAOYSA-N Synonym: 3-bromofluorobenzene,m-bromofluorobenzene,m-fluorobromobenzene,benzene, 1-bromo-3-fluoro,3-bromfluorbenzen,3-fluorobromobenzene,m-fluorophenyl bromide,1-fluoro-3-bromobenzene,3-fluoro bromobenzene,benzene, 1-fluoro-3-bromo PubChem CID: 14082 IUPAC Name: 1-bromo-3-fluorobenzene

PubChem CID 14082
CAS 1073-06-9
MDL Number MFCD00000326
Synonym 3-bromofluorobenzene,m-bromofluorobenzene,m-fluorobromobenzene,benzene, 1-bromo-3-fluoro,3-bromfluorbenzen,3-fluorobromobenzene,m-fluorophenyl bromide,1-fluoro-3-bromobenzene,3-fluoro bromobenzene,benzene, 1-fluoro-3-bromo
IUPAC Name 1-bromo-3-fluorobenzene
InChI Key QDFKKJYEIFBEFC-UHFFFAOYSA-N
Molecular Formula C6H4BrF
1,078

2,4-Dichloro-1-(2-iodophenoxy)benzene, ≥95%, Thermo Scientific™

CAS: 175136-78-4 Molecular Formula: C12H7Cl2IO Molecular Weight (g/mol): 364.99 MDL Number: MFCD00052444 InChI Key: ULAWXTPGHWKSDY-UHFFFAOYSA-N Synonym: 2,4-dichloro-1-2-iodophenoxy benzene,2,4-dichloro-1 2-iodophenoxy benzene,benzene,2,4-dichloro-1-2-iodophenoxy PubChem CID: 2776994 IUPAC Name: 2,4-dichloro-1-(2-iodophenoxy)benzene SMILES: ClC1=CC(Cl)=C(OC2=CC=CC=C2I)C=C1

PubChem CID 2776994
CAS 175136-78-4
Molecular Weight (g/mol) 364.99
MDL Number MFCD00052444
SMILES ClC1=CC(Cl)=C(OC2=CC=CC=C2I)C=C1
Synonym 2,4-dichloro-1-2-iodophenoxy benzene,2,4-dichloro-1 2-iodophenoxy benzene,benzene,2,4-dichloro-1-2-iodophenoxy
IUPAC Name 2,4-dichloro-1-(2-iodophenoxy)benzene
InChI Key ULAWXTPGHWKSDY-UHFFFAOYSA-N
Molecular Formula C12H7Cl2IO
1,079

(1S,2R)-(-)-cis-1-Amino-2-indanol, 99%

CAS: 126456-43-7 Molecular Formula: C9H12NO Molecular Weight (g/mol): 150.20 MDL Number: MFCD00216655 InChI Key: LOPKSXMQWBYUOI-BDAKNGLRSA-O PubChem CID: 9866743 SMILES: [NH3+][C@@H]1[C@H](O)CC2=CC=CC=C12

PubChem CID 9866743
CAS 126456-43-7
Molecular Weight (g/mol) 150.20
MDL Number MFCD00216655
SMILES [NH3+][C@@H]1[C@H](O)CC2=CC=CC=C12
InChI Key LOPKSXMQWBYUOI-BDAKNGLRSA-O
Molecular Formula C9H12NO
1,080

(Phenylsulfonyl)acetic acid, 97%

CAS: 3959-23-7 Molecular Formula: C8H8O4S Molecular Weight (g/mol): 200.208 MDL Number: MFCD00025042 InChI Key: YTEFAALYDTWTLB-UHFFFAOYSA-N Synonym: phenylsulfonyl acetic acid,2-phenylsulfonyl acetic acid,2-benzenesulfonyl acetic acid,phenylsulfonylacetic acid,acetic acid, phenylsulfonyl,benzenesulfonyl-acetic acid,benzenesulfonyl acetic acid,2-phenylsulphonyl acetic acid,benzenesulfonylacetic acid,phenyl sulfonylacetic acid PubChem CID: 59543 IUPAC Name: 2-(benzenesulfonyl)acetic acid SMILES: C1=CC=C(C=C1)S(=O)(=O)CC(=O)O

PubChem CID 59543
CAS 3959-23-7
Molecular Weight (g/mol) 200.208
MDL Number MFCD00025042
SMILES C1=CC=C(C=C1)S(=O)(=O)CC(=O)O
Synonym phenylsulfonyl acetic acid,2-phenylsulfonyl acetic acid,2-benzenesulfonyl acetic acid,phenylsulfonylacetic acid,acetic acid, phenylsulfonyl,benzenesulfonyl-acetic acid,benzenesulfonyl acetic acid,2-phenylsulphonyl acetic acid,benzenesulfonylacetic acid,phenyl sulfonylacetic acid
IUPAC Name 2-(benzenesulfonyl)acetic acid
InChI Key YTEFAALYDTWTLB-UHFFFAOYSA-N
Molecular Formula C8H8O4S