1.0 2010-04-08 22:08:57 UTC 2025-11-18 23:18:26 UTC FDB010074 1-Phenyl-3 or 5-propylpyrazole It is used as a food additive . C12H14N2 186.258 186.115698459 1-phenyl-3-propyl-1H-pyrazole 1-phenyl-3-propylpyrazole 65504-93-0 CCCC1=NN(C=C1)C1=CC=CC=C1 InChI=1S/C12H14N2/c1-2-6-11-9-10-14(13-11)12-7-4-3-5-8-12/h3-5,7-10H,2,6H2,1H3 ZHVUSSKUCZSPFQ-UHFFFAOYSA-N belongs to the class of organic compounds known as phenylpyrazoles. Phenylpyrazoles are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group. Phenylpyrazoles Organic compounds Organoheterocyclic compounds Azoles Pyrazoles Aromatic heteromonocyclic compounds Azacyclic compounds Benzene and substituted derivatives Heteroaromatic compounds Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Aromatic heteromonocyclic compound Azacycle Benzenoid Heteroaromatic compound Hydrocarbon derivative Monocyclic benzene moiety Organic nitrogen compound Organonitrogen compound Organopnictogen compound Phenylpyrazole logp 3.87 ALOGPS logs -2.47 ALOGPS solubility 6.25e-01 g/l ALOGPS logp 3.34 ChemAxon pka_strongest_basic 2.88 ChemAxon iupac 1-phenyl-3-propyl-1H-pyrazole ChemAxon average_mass 186.258 ChemAxon mono_mass 186.115698459 ChemAxon smiles CCCC1=NN(C=C1)C1=CC=CC=C1 ChemAxon formula C12H14N2 ChemAxon inchi InChI=1S/C12H14N2/c1-2-6-11-9-10-14(13-11)12-7-4-3-5-8-12/h3-5,7-10H,2,6H2,1H3 ChemAxon inchikey ZHVUSSKUCZSPFQ-UHFFFAOYSA-N ChemAxon polar_surface_area 17.82 ChemAxon refractivity 58.24 ChemAxon polarizability 22 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 105768 Specdb::MsMs 105769 Specdb::MsMs 105770 Specdb::MsMs 172335 Specdb::MsMs 172336 Specdb::MsMs 172337 Specdb::MsMs 3605092 Specdb::MsMs 3605093 Specdb::MsMs 3605094 Specdb::MsMs 3605095 Specdb::MsMs 3605096 Specdb::MsMs 3605097 cooked roasted