1.0 2010-04-08 22:06:02 UTC 2025-11-18 22:54:32 UTC FDB003974 Pentenylbenzene Pentenylbenzene is a member of the class of compounds known as styrenes. Styrenes are organic compounds containing an ethenylbenzene moiety. Pentenylbenzene can be found in wild celery, which makes pentenylbenzene a potential biomarker for the consumption of this food product. (1E)-1-Pentenylbenzene 1-Pentene, 1-phenyl- 1-pentenylbenzene Benzene, 1-pentenyl- Benzene, 1-pentenyl-, trans trans-1-Phenyl-1-pentene C11H14 146.2289 146.109550448 (1E)-pent-1-en-1-ylbenzene benzene, 1-pentenyl- CCC\C=C\C1=CC=CC=C1 InChI=1S/C11H14/c1-2-3-5-8-11-9-6-4-7-10-11/h4-10H,2-3H2,1H3/b8-5+ KHMYONNPZWOTKW-VMPITWQZSA-N belongs to the class of organic compounds known as styrenes. These are organic compounds containing an ethenylbenzene moiety. Styrenes Organic compounds Benzenoids Benzene and substituted derivatives Styrenes Aromatic homomonocyclic compounds Aromatic hydrocarbons Cyclic olefins Aromatic homomonocyclic compound Aromatic hydrocarbon Cyclic olefin Hydrocarbon Olefin Styrene Unsaturated hydrocarbon logp 4.36 ALOGPS logs -4.19 ALOGPS solubility 9.46e-03 g/l ALOGPS logp 3.99 ChemAxon iupac (1E)-pent-1-en-1-ylbenzene ChemAxon average_mass 146.2289 ChemAxon mono_mass 146.109550448 ChemAxon smiles CCC\C=C\C1=CC=CC=C1 ChemAxon formula C11H14 ChemAxon inchi InChI=1S/C11H14/c1-2-3-5-8-11-9-6-4-7-10-11/h4-10H,2-3H2,1H3/b8-5+ ChemAxon inchikey KHMYONNPZWOTKW-VMPITWQZSA-N ChemAxon polar_surface_area 0 ChemAxon refractivity 50.62 ChemAxon polarizability 18.48 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 0 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 95268 Specdb::MsMs 95269 Specdb::MsMs 95270 Specdb::MsMs 159489 Specdb::MsMs 159490 Specdb::MsMs 159491 Specdb::MsMs 3599726 Specdb::MsMs 3599727 Specdb::MsMs 3599728 Specdb::MsMs 3599729 Specdb::MsMs 3599730 Specdb::MsMs 3599731 Wild celery Type 1 specific Apium graveolens 4045