1.0 2010-04-08 22:14:30 UTC 2019-11-26 03:17:45 UTC FDB019667 2,3-Dimethyl-5-(2-propenyl)pyrazine Constituent of roasted peanut volatiles. 2,3-Dimethyl-5-(2-propenyl)pyrazine is found in nuts. 5-Allyl-2,3-dimethylpyrazine C9H12N2 148.205 148.100048394 2,3-dimethyl-5-(prop-2-en-1-yl)pyrazine 2,3-dimethyl-5-(prop-2-en-1-yl)pyrazine 55138-68-6 CC1=C(C)N=C(CC=C)C=N1 InChI=1S/C9H12N2/c1-4-5-9-6-10-7(2)8(3)11-9/h4,6H,1,5H2,2-3H3 WBJYPKOZOKJWSD-UHFFFAOYSA-N belongs to the class of organic compounds known as pyrazines. Pyrazines are compounds containing a pyrazine ring, which is a six-member aromatic heterocycle, that consists of two nitrogen atoms (at positions 1 and 4) and four carbon atoms. Pyrazines Organic compounds Organoheterocyclic compounds Diazines Pyrazines Aromatic heteromonocyclic compounds Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Aromatic heteromonocyclic compound Azacycle Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organonitrogen compound Organopnictogen compound Pyrazine logp 1.92 ALOGPS logs -1.18 ALOGPS solubility 9.83e+00 g/l ALOGPS logp 0.77 ChemAxon pka_strongest_basic 1.24 ChemAxon iupac 2,3-dimethyl-5-(prop-2-en-1-yl)pyrazine ChemAxon average_mass 148.205 ChemAxon mono_mass 148.100048394 ChemAxon smiles CC1=C(C)N=C(CC=C)C=N1 ChemAxon formula C9H12N2 ChemAxon inchi InChI=1S/C9H12N2/c1-4-5-9-6-10-7(2)8(3)11-9/h4,6H,1,5H2,2-3H3 ChemAxon inchikey WBJYPKOZOKJWSD-UHFFFAOYSA-N ChemAxon polar_surface_area 25.78 ChemAxon refractivity 44.79 ChemAxon polarizability 17 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 26198 Specdb::CMs 170483 Specdb::MsIr 8426 Specdb::MsIr 8427 Specdb::MsMs 324046 Specdb::MsMs 324047 Specdb::MsMs 324048 Specdb::MsMs 372367 Specdb::MsMs 372368 Specdb::MsMs 372369 Specdb::MsMs 2696982 Specdb::MsMs 2696983 Specdb::MsMs 2696984 Specdb::MsMs 2981633 Specdb::MsMs 2981634 Specdb::MsMs 2981635 Specdb::NmrOneD 37642 Specdb::NmrOneD 37643 Specdb::NmrOneD 37644 Specdb::NmrOneD 37645 Specdb::NmrOneD 37646 Specdb::NmrOneD 37647 Specdb::NmrOneD 37648 Specdb::NmrOneD 37649 Specdb::NmrOneD 37650 Specdb::NmrOneD 37651 Specdb::NmrOneD 37652 Specdb::NmrOneD 37653 Specdb::NmrOneD 37654 Specdb::NmrOneD 37655 Specdb::NmrOneD 37656 Specdb::NmrOneD 37657 Specdb::NmrOneD 37658 Specdb::NmrOneD 37659 Specdb::NmrOneD 37660 Specdb::NmrOneD 37661 HMDB39985 #<Reference:0x000055ce2f532d68> Nuts Unknown generic