Secondary metabolite:1-Methyl-4-(prop-1-en-2-yl)benzene



EOCID003184
Summary

sCentInDB Chemical identifier: EOCID003184

Chemical name: 1-Methyl-4-(prop-1-en-2-yl)benzene

Molecular formula: C10H12

SMILES: Cc1ccc(cc1)C(=C)C

InChI: InChI=1S/C10H12/c1-8(2)10-6-4-9(3)5-7-10/h4-7H,1H2,2-3H3

InChIKey: MMSLOZQEMPDGPI-UHFFFAOYSA-N

Chemical classification

Kingdom: Organic compounds

Superclass: Benzenoids

Class: Benzene and substituted derivatives

Subclass: Phenylpropenes

Synonymous chemical name(s):
α-p-dimethyl-styrene, p-cymenene, ρ-cymenene, α,p-dimethylstyrene, dehydro-p-cymene, α,para-dimethyl styrene, para-cymenene, α-p-dimethyl styrene, α-,p-dimethystyrene, β-cymenene, α,p-dirnethylstyrene, α-p-dimethylstyrene

External chemical identifier(s):
CID:62385, CHEMSPIDER:56173, ZINC000001584796, FDASRS:XC8HY3OB86, MOLPORT:003-960-066, SURECHEMBL:SCHEMBL94501

Spectrabase ID: LlWaEMBKAkN

Chemical structure download

2D:2D MOL2D MOL22D SDF
3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT
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