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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 (120,443)
Phenols (23,261)
Naphthalenes (6,113)
Phenol esters (4,239)
Unsubstituted Phenols (1,422)
Fluorenes (1,299)
Thiophenols (729)
Anthracenes (509)
Indanes (460)
Phenanthrenes and derivatives (364)
Tetralins (341)
Triphenyl compounds (280)
Pyrenes (279)
Dibenzocycloheptenes (61)
Naphthacenes (36)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (17)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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5,926 – 5,940 of 146,626 results
5,926

1-Eth-1-ynyl-4-propylbenzene, 97%, Thermo Scientific™

CAS: 62452-73-7 Molecular Formula: C11H12 Molecular Weight (g/mol): 144.217 MDL Number: MFCD00173886 InChI Key: UVFFOABHOIMLNB-UHFFFAOYSA-N Synonym: 4-propylphenylacetylene,1-eth-1-ynyl-4-propylbenzene,4-n-propylphenylacetylene,1-ethynyl-4-propyl-benzene,benzene, 1-ethynyl-4-propyl,pubchem10973,4-n-propylphenyl ethine,4-propyl phenylacetylene,4-ethynyl-1-propylbenzene,4-propyl-1-ethynylbenzene PubChem CID: 2775133 IUPAC Name: 1-ethynyl-4-propylbenzene SMILES: CCCC1=CC=C(C=C1)C#C

PubChem CID 2775133
CAS 62452-73-7
Molecular Weight (g/mol) 144.217
MDL Number MFCD00173886
SMILES CCCC1=CC=C(C=C1)C#C
Synonym 4-propylphenylacetylene,1-eth-1-ynyl-4-propylbenzene,4-n-propylphenylacetylene,1-ethynyl-4-propyl-benzene,benzene, 1-ethynyl-4-propyl,pubchem10973,4-n-propylphenyl ethine,4-propyl phenylacetylene,4-ethynyl-1-propylbenzene,4-propyl-1-ethynylbenzene
IUPAC Name 1-ethynyl-4-propylbenzene
InChI Key UVFFOABHOIMLNB-UHFFFAOYSA-N
Molecular Formula C11H12
5,927
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1-Iodo-4-n-propylbenzene, 97%

CAS: 126261-84-5 Molecular Formula: C9H11I Molecular Weight (g/mol): 246.09 MDL Number: MFCD00051612 InChI Key: ZRWCHMFGMKNWEC-UHFFFAOYSA-N Synonym: 1-iodo-4-n-propylbenzene,1-iodo-4-propyl-benzene,4-iodopropylbenzene,4-propyliodobenzene,p-n-propyliodobenzene,4-iodo-n-propylbenzene,4-n-propyl iodobenzene,#,benzene,1-iodo-4-propyl,1-iodanyl-4-propyl-benzene PubChem CID: 612541 IUPAC Name: 1-iodo-4-propylbenzene SMILES: CCCC1=CC=C(I)C=C1

PubChem CID 612541
CAS 126261-84-5
Molecular Weight (g/mol) 246.09
MDL Number MFCD00051612
SMILES CCCC1=CC=C(I)C=C1
Synonym 1-iodo-4-n-propylbenzene,1-iodo-4-propyl-benzene,4-iodopropylbenzene,4-propyliodobenzene,p-n-propyliodobenzene,4-iodo-n-propylbenzene,4-n-propyl iodobenzene,#,benzene,1-iodo-4-propyl,1-iodanyl-4-propyl-benzene
IUPAC Name 1-iodo-4-propylbenzene
InChI Key ZRWCHMFGMKNWEC-UHFFFAOYSA-N
Molecular Formula C9H11I
5,928
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(R)-(-)-2-Phenylbutyric acid, 99%

CAS: 938-79-4 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00063165 InChI Key: OFJWFSNDPCAWDK-UHFFFAOYNA-N Synonym: r---2-phenylbutyric acid,2r-2-phenylbutanoic acid,2-phenylbutyric acid, r,r-2-phenylbutyric acid,benzeneacetic acid, alpha-ethyl-, r,r-2-phenylbutanoic acid,2r-2-phenyl-butanoic acid,2r-2-phenyl-mutanoic acid,r---2-phenylbutanoic acid,benzeneacetic acid,a-ethyl-, ar PubChem CID: 785330 IUPAC Name: (2R)-2-phenylbutanoic acid SMILES: CCC(C(O)=O)C1=CC=CC=C1

PubChem CID 785330
CAS 938-79-4
Molecular Weight (g/mol) 164.20
MDL Number MFCD00063165
SMILES CCC(C(O)=O)C1=CC=CC=C1
Synonym r---2-phenylbutyric acid,2r-2-phenylbutanoic acid,2-phenylbutyric acid, r,r-2-phenylbutyric acid,benzeneacetic acid, alpha-ethyl-, r,r-2-phenylbutanoic acid,2r-2-phenyl-butanoic acid,2r-2-phenyl-mutanoic acid,r---2-phenylbutanoic acid,benzeneacetic acid,a-ethyl-, ar
IUPAC Name (2R)-2-phenylbutanoic acid
InChI Key OFJWFSNDPCAWDK-UHFFFAOYNA-N
Molecular Formula C10H12O2
5,929
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(+/-)-2-Phenylbutyric acid, 98%, Thermo Scientific Chemicals

CAS: 90-27-7 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00002667 InChI Key: OFJWFSNDPCAWDK-UHFFFAOYSA-N Synonym: 2-phenylbutyric acid,alpha-ethylphenylacetic acid,butyric acid, 2-phenyl,alpha-phenylbutyric acid,benzeneacetic acid, .alpha.-ethyl,alpha-phenyl butyric acid,2-phenylbutyricacid,benzeneacetic acid, alpha-ethyl,2-phenylburyric acid,alpha-toluic acid, alpha-ethyl PubChem CID: 7012 ChEBI: CHEBI:86545 IUPAC Name: 2-phenylbutanoic acid SMILES: CCC(C1=CC=CC=C1)C(=O)O

PubChem CID 7012
CAS 90-27-7
Molecular Weight (g/mol) 164.204
ChEBI CHEBI:86545
MDL Number MFCD00002667
SMILES CCC(C1=CC=CC=C1)C(=O)O
Synonym 2-phenylbutyric acid,alpha-ethylphenylacetic acid,butyric acid, 2-phenyl,alpha-phenylbutyric acid,benzeneacetic acid, .alpha.-ethyl,alpha-phenyl butyric acid,2-phenylbutyricacid,benzeneacetic acid, alpha-ethyl,2-phenylburyric acid,alpha-toluic acid, alpha-ethyl
IUPAC Name 2-phenylbutanoic acid
InChI Key OFJWFSNDPCAWDK-UHFFFAOYSA-N
Molecular Formula C10H12O2
5,930
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4-Fluorophenylacetone, 99%

CAS: 459-03-0 Molecular Formula: C9H9FO Molecular Weight (g/mol): 152.17 MDL Number: MFCD00000362 InChI Key: ZUEKIIWSVFBTCM-UHFFFAOYSA-N Synonym: 4-fluorophenylacetone,4-fluorophenyl acetone,1-4-fluorophenyl propan-2-one,1-4-fluorophenyl acetone,1-4-fluorophenyl-2-propanone,2-propanone, 1-4-fluorophenyl,p-fluorophenyl acetone,1-acetonyl-4-fluorobenzene,1-4-fluoro-phenyl-propan-2-one PubChem CID: 521187 IUPAC Name: 1-(4-fluorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=C(F)C=C1

PubChem CID 521187
CAS 459-03-0
Molecular Weight (g/mol) 152.17
MDL Number MFCD00000362
SMILES CC(=O)CC1=CC=C(F)C=C1
Synonym 4-fluorophenylacetone,4-fluorophenyl acetone,1-4-fluorophenyl propan-2-one,1-4-fluorophenyl acetone,1-4-fluorophenyl-2-propanone,2-propanone, 1-4-fluorophenyl,p-fluorophenyl acetone,1-acetonyl-4-fluorobenzene,1-4-fluoro-phenyl-propan-2-one
IUPAC Name 1-(4-fluorophenyl)propan-2-one
InChI Key ZUEKIIWSVFBTCM-UHFFFAOYSA-N
Molecular Formula C9H9FO
5,931
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(S)-(-)-1-Phenylpropyl isocyanate, 95%

CAS: 164033-12-9 Molecular Formula: C10H11NO Molecular Weight (g/mol): 161.204 MDL Number: MFCD05664090 InChI Key: XGPXXSJFZSZULR-JTQLQIEISA-N Synonym: s---1-phenylpropyl isocyanate,s-1-phenylpropyl isocyanate,1s-1-isocyanatopropyl benzene,benzene, 1-isocyanatopropyl-, s,5-1-isocyanatopropyl benzene,s-1-isocyanatopropyl benzene,benzene, 1s-1-isocyanatopropyl PubChem CID: 7018275 IUPAC Name: [(1S)-1-isocyanatopropyl]benzene SMILES: CCC(C1=CC=CC=C1)N=C=O

PubChem CID 7018275
CAS 164033-12-9
Molecular Weight (g/mol) 161.204
MDL Number MFCD05664090
SMILES CCC(C1=CC=CC=C1)N=C=O
Synonym s---1-phenylpropyl isocyanate,s-1-phenylpropyl isocyanate,1s-1-isocyanatopropyl benzene,benzene, 1-isocyanatopropyl-, s,5-1-isocyanatopropyl benzene,s-1-isocyanatopropyl benzene,benzene, 1s-1-isocyanatopropyl
IUPAC Name [(1S)-1-isocyanatopropyl]benzene
InChI Key XGPXXSJFZSZULR-JTQLQIEISA-N
Molecular Formula C10H11NO
5,932
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4-tert-Butylstyrene, 94%, stab. with 50 ppm 4-tert-butylcatechol

CAS: 1746-23-2 Molecular Formula: C12H16 Molecular Weight (g/mol): 160.26 MDL Number: MFCD00065126 InChI Key: QEDJMOONZLUIMC-UHFFFAOYSA-N Synonym: 4-tert-butylstyrene,p-tert-butylstyrene,p-t-butylstyrene,benzene, 1-1,1-dimethylethyl-4-ethenyl,styrene, p-tert-butyl,unii-9pct9cbw0v,1-1,1-dimethylethyl-4-ethenylbenzene,9pct9cbw0v,1-tert-butyl-4-vinylbenzene,4-t-butyl styrene PubChem CID: 15627 IUPAC Name: 1-tert-butyl-4-ethenylbenzene SMILES: CC(C)(C)C1=CC=C(C=C1)C=C

PubChem CID 15627
CAS 1746-23-2
Molecular Weight (g/mol) 160.26
MDL Number MFCD00065126
SMILES CC(C)(C)C1=CC=C(C=C1)C=C
Synonym 4-tert-butylstyrene,p-tert-butylstyrene,p-t-butylstyrene,benzene, 1-1,1-dimethylethyl-4-ethenyl,styrene, p-tert-butyl,unii-9pct9cbw0v,1-1,1-dimethylethyl-4-ethenylbenzene,9pct9cbw0v,1-tert-butyl-4-vinylbenzene,4-t-butyl styrene
IUPAC Name 1-tert-butyl-4-ethenylbenzene
InChI Key QEDJMOONZLUIMC-UHFFFAOYSA-N
Molecular Formula C12H16
5,933

Hexestrol, 98+%, Thermo Scientific Chemicals

CAS: 84-16-2 Molecular Formula: C18H22O2 Molecular Weight (g/mol): 270.37 MDL Number: MFCD00068996 InChI Key: PBBGSZCBWVPOOL-UHFFFAOYNA-N Synonym: hexestrol,meso-hexestrol,hexoestrol,hexanoestrol,hexestrofen,mesohexestrol,erythrohexestrol,estra-plex,cycloestrol,estrifar PubChem CID: 192197 SMILES: CCC(C(CC)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1

PubChem CID 192197
CAS 84-16-2
Molecular Weight (g/mol) 270.37
MDL Number MFCD00068996
SMILES CCC(C(CC)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1
Synonym hexestrol,meso-hexestrol,hexoestrol,hexanoestrol,hexestrofen,mesohexestrol,erythrohexestrol,estra-plex,cycloestrol,estrifar
InChI Key PBBGSZCBWVPOOL-UHFFFAOYNA-N
Molecular Formula C18H22O2
5,934
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4-tert-Pentylphenol, 99%

CAS: 80-46-6 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.248 MDL Number: MFCD00002369 InChI Key: NRZWYNLTFLDQQX-UHFFFAOYSA-N Synonym: 4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol PubChem CID: 6643 ChEBI: CHEBI:35096 IUPAC Name: 4-(2-methylbutan-2-yl)phenol SMILES: CCC(C)(C)C1=CC=C(C=C1)O

PubChem CID 6643
CAS 80-46-6
Molecular Weight (g/mol) 164.248
ChEBI CHEBI:35096
MDL Number MFCD00002369
SMILES CCC(C)(C)C1=CC=C(C=C1)O
Synonym 4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol
IUPAC Name 4-(2-methylbutan-2-yl)phenol
InChI Key NRZWYNLTFLDQQX-UHFFFAOYSA-N
Molecular Formula C11H16O
5,935
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4-(tert-Butyl)benzylbromide, 97%

CAS: 18880-00-7 Molecular Formula: C11H15Br Molecular Weight (g/mol): 227.14 MDL Number: MFCD00000180 InChI Key: QZNQSIHCDAGZIA-UHFFFAOYSA-N Synonym: 4-tert-butylbenzyl bromide,p-tert-butylbenzyl bromide,1-bromomethyl-4-tert-butyl benzene,4-tert-butylbenzylbromide,1-bromomethyl-4-tert-butylbenzene,4-tert-butyl benzylbromide,p-t-butylbenzyl bromide,1-bromomethyl-4-1,1-dimethylethyl benzene,4-t-butylbenzylbromide,4-tert-buthylbenzyl bromide PubChem CID: 87836 IUPAC Name: 1-(bromomethyl)-4-tert-butylbenzene SMILES: CC(C)(C)C1=CC=C(C=C1)CBr

PubChem CID 87836
CAS 18880-00-7
Molecular Weight (g/mol) 227.14
MDL Number MFCD00000180
SMILES CC(C)(C)C1=CC=C(C=C1)CBr
Synonym 4-tert-butylbenzyl bromide,p-tert-butylbenzyl bromide,1-bromomethyl-4-tert-butyl benzene,4-tert-butylbenzylbromide,1-bromomethyl-4-tert-butylbenzene,4-tert-butyl benzylbromide,p-t-butylbenzyl bromide,1-bromomethyl-4-1,1-dimethylethyl benzene,4-t-butylbenzylbromide,4-tert-buthylbenzyl bromide
IUPAC Name 1-(bromomethyl)-4-tert-butylbenzene
InChI Key QZNQSIHCDAGZIA-UHFFFAOYSA-N
Molecular Formula C11H15Br
5,936
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1,3-Dioxolane, 99.8%, anhydrous, stabilized with 75 ppm BHT, AcroSeal™

CAS: 646-06-0 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 InChI Key: WNXJIVFYUVYPPR-UHFFFAOYSA-N Synonym: dioxolane,glycolformal,formal glycol,1,3-dioxolan,1,3-dioxacyclopentane,1,3-dioxalane,ethylene glycol formal,glycol methylene ether,glycol formal,dioxolan czech PubChem CID: 31404 ChEBI: CHEBI:34247 IUPAC Name: 2,6-ditert-butyl-4-methylphenol SMILES: CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

PubChem CID 31404
CAS 646-06-0
Molecular Weight (g/mol) 74.08
ChEBI CHEBI:34247
SMILES CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C
Synonym dioxolane,glycolformal,formal glycol,1,3-dioxolan,1,3-dioxacyclopentane,1,3-dioxalane,ethylene glycol formal,glycol methylene ether,glycol formal,dioxolan czech
IUPAC Name 2,6-ditert-butyl-4-methylphenol
InChI Key WNXJIVFYUVYPPR-UHFFFAOYSA-N
Molecular Formula C3H6O2
5,937
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4-tert-Butylaniline, 99%

CAS: 769-92-6 Molecular Formula: C10H15N Molecular Weight (g/mol): 149.24 MDL Number: MFCD00007899 InChI Key: WRDWWAVNELMWAM-UHFFFAOYSA-N Synonym: 4-tert-butyl aniline,p-tert-butylaniline,benzenamine, 4-1,1-dimethylethyl,p-t-butylaniline,4-t-butylaniline,unii-47h9440zow,4-t-butylbenzeneamine,4-tert-butylbenzenamine,4-tert-butylbenzeneamine PubChem CID: 69861 IUPAC Name: 4-tert-butylaniline SMILES: CC(C)(C)C1=CC=C(C=C1)N

PubChem CID 69861
CAS 769-92-6
Molecular Weight (g/mol) 149.24
MDL Number MFCD00007899
SMILES CC(C)(C)C1=CC=C(C=C1)N
Synonym 4-tert-butyl aniline,p-tert-butylaniline,benzenamine, 4-1,1-dimethylethyl,p-t-butylaniline,4-t-butylaniline,unii-47h9440zow,4-t-butylbenzeneamine,4-tert-butylbenzenamine,4-tert-butylbenzeneamine
IUPAC Name 4-tert-butylaniline
InChI Key WRDWWAVNELMWAM-UHFFFAOYSA-N
Molecular Formula C10H15N
5,938
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4-tert-Butylphenylmagnesium bromide, 0.50 M in 2-MeTHF

CAS: 63488-10-8 Molecular Formula: C10H13BrMg Molecular Weight (g/mol): 237.42 MDL Number: MFCD00013244 InChI Key: YECFWFOEQLAVNH-UHFFFAOYSA-M Synonym: 4-tert-butylphenylmagnesium bromide,4-t-butylphenylmagnesium bromide,bromo 4-tert-butylphenyl magnesium,magnesium, bromo 4-1,1-dimethylethyl phenyl,4-tert-butylphenylmagnesium bromide solution,yecfwfoeqlavnh-uhfffaoysa-m,4-tert-butylphenyhnagnesium bromide,4-tert.-butylphenylmagnesium bromide,4-tert-butylphenyl magnesium bromide,4-tert butyl phenyl magnesium bromide,grignard reagent PubChem CID: 4608371 IUPAC Name: magnesium;tert-butylbenzene;bromide SMILES: CC(C)(C)C1=CC=C([Mg]Br)C=C1

PubChem CID 4608371
CAS 63488-10-8
Molecular Weight (g/mol) 237.42
MDL Number MFCD00013244
SMILES CC(C)(C)C1=CC=C([Mg]Br)C=C1
Synonym 4-tert-butylphenylmagnesium bromide,4-t-butylphenylmagnesium bromide,bromo 4-tert-butylphenyl magnesium,magnesium, bromo 4-1,1-dimethylethyl phenyl,4-tert-butylphenylmagnesium bromide solution,yecfwfoeqlavnh-uhfffaoysa-m,4-tert-butylphenyhnagnesium bromide,4-tert.-butylphenylmagnesium bromide,4-tert-butylphenyl magnesium bromide,4-tert butyl phenyl magnesium bromide,grignard reagent
IUPAC Name magnesium;tert-butylbenzene;bromide
InChI Key YECFWFOEQLAVNH-UHFFFAOYSA-M
Molecular Formula C10H13BrMg
5,939

N-(4-tert-butylbenzyl)-N-methylamine, Thermo Scientific™

CAS: 65542-26-9 Molecular Formula: C12H19N Molecular Weight (g/mol): 177.291 InChI Key: ZSHCHOYJMLEAOX-UHFFFAOYSA-N Synonym: n-4-tert-butylbenzyl-n-methylamine,4-tert-butylphenyl methyl methyl amine,1-4-tert-butyl phenyl-n-methylmethanamine,1-4-tert-butylphenyl-n-methylmethanamine,4-tert-butylbenzylmethylamine,n-methyl-4-tert-butylbenzylamine,n-methyl-4-tert.butylbenzylamine,n-methyl 4-tert-butylbenzyl amine,4-tert-butyl phenyl methyl methylamine,benzenemethanamine,4-1,1-dimethylethyl-n-methyl PubChem CID: 2396874 IUPAC Name: 1-(4-tert-butylphenyl)-N-methylmethanamine SMILES: CC(C)(C)C1=CC=C(C=C1)CNC

PubChem CID 2396874
CAS 65542-26-9
Molecular Weight (g/mol) 177.291
SMILES CC(C)(C)C1=CC=C(C=C1)CNC
Synonym n-4-tert-butylbenzyl-n-methylamine,4-tert-butylphenyl methyl methyl amine,1-4-tert-butyl phenyl-n-methylmethanamine,1-4-tert-butylphenyl-n-methylmethanamine,4-tert-butylbenzylmethylamine,n-methyl-4-tert-butylbenzylamine,n-methyl-4-tert.butylbenzylamine,n-methyl 4-tert-butylbenzyl amine,4-tert-butyl phenyl methyl methylamine,benzenemethanamine,4-1,1-dimethylethyl-n-methyl
IUPAC Name 1-(4-tert-butylphenyl)-N-methylmethanamine
InChI Key ZSHCHOYJMLEAOX-UHFFFAOYSA-N
Molecular Formula C12H19N
5,940
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1-Nitro-4-n-propylbenzene, 96%

CAS: 10342-59-3 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 MDL Number: MFCD00051839 InChI Key: SXQBFCVVZIYXHV-UHFFFAOYSA-N Synonym: 1-nitro-4-propyl-benzene,1-nitro-4-n-propylbenzene,4-nitro-n-propylbenzene,4-propylnitrobenzene,benzene, 1-nitro-4-propyl,p-nitropropylbenzene,p-propylnitrobenzene,1-nitro-4-propylbenzol PubChem CID: 82559 IUPAC Name: 1-nitro-4-propylbenzene SMILES: CCCC1=CC=C(C=C1)[N+]([O-])=O

PubChem CID 82559
CAS 10342-59-3
Molecular Weight (g/mol) 165.19
MDL Number MFCD00051839
SMILES CCCC1=CC=C(C=C1)[N+]([O-])=O
Synonym 1-nitro-4-propyl-benzene,1-nitro-4-n-propylbenzene,4-nitro-n-propylbenzene,4-propylnitrobenzene,benzene, 1-nitro-4-propyl,p-nitropropylbenzene,p-propylnitrobenzene,1-nitro-4-propylbenzol
IUPAC Name 1-nitro-4-propylbenzene
InChI Key SXQBFCVVZIYXHV-UHFFFAOYSA-N
Molecular Formula C9H11NO2