1.0 2010-04-08 22:15:30 UTC 2015-07-21 06:50:53 UTC FDB021160 2-Methyl-3-propylpyrazine Flavour component of cooked foods 2-Methyl-3-n-propylpyrazine 2-Methyl-3-propyl-pyrazine 2-Propyl-3-methylpyrazine 3-Propyl-2-methyl pyrazine 3-Propyl-2-methylpyrazine Pyrazine, 2-methyl-3-propyl- C8H12N2 136.1943 136.100048394 2-methyl-3-propylpyrazine pyrazine, 2-methyl-3-propyl- 15986-80-8 CCCC1=C(C)N=CC=N1 InChI=1S/C8H12N2/c1-3-4-8-7(2)9-5-6-10-8/h5-6H,3-4H2,1-2H3 XAWKNALRUSOTOY-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 1.64 ALOGPS logs -0.67 ALOGPS solubility 2.92e+01 g/l ALOGPS logp 0.95 ChemAxon pka_strongest_basic 1.5 ChemAxon iupac 2-methyl-3-propylpyrazine ChemAxon average_mass 136.1943 ChemAxon mono_mass 136.100048394 ChemAxon smiles CCCC1=C(C)N=CC=N1 ChemAxon formula C8H12N2 ChemAxon inchi InChI=1S/C8H12N2/c1-3-4-8-7(2)9-5-6-10-8/h5-6H,3-4H2,1-2H3 ChemAxon inchikey XAWKNALRUSOTOY-UHFFFAOYSA-N ChemAxon polar_surface_area 25.78 ChemAxon refractivity 40.16 ChemAxon polarizability 15.72 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 13647 Specdb::CMs 135039 Specdb::CMs 142773 Specdb::MsIr 9163 Specdb::MsIr 9164 Specdb::NmrOneD 45662 Specdb::NmrOneD 45663 Specdb::NmrOneD 45664 Specdb::NmrOneD 45665 Specdb::NmrOneD 45666 Specdb::NmrOneD 45667 Specdb::NmrOneD 45668 Specdb::NmrOneD 45669 Specdb::NmrOneD 45670 Specdb::NmrOneD 45671 Specdb::NmrOneD 45672 Specdb::NmrOneD 45673 Specdb::NmrOneD 45674 Specdb::NmrOneD 45675 Specdb::NmrOneD 45676 Specdb::NmrOneD 45677 Specdb::NmrOneD 45678 Specdb::NmrOneD 45679 Specdb::NmrOneD 45680 Specdb::NmrOneD 45681 Specdb::MsMs 296083 Specdb::MsMs 296084 Specdb::MsMs 296085 Specdb::MsMs 337291 Specdb::MsMs 337292 Specdb::MsMs 337293 Specdb::MsMs 2701069 Specdb::MsMs 2701070 Specdb::MsMs 2701071 Specdb::MsMs 3007121 Specdb::MsMs 3007122 Specdb::MsMs 3007123 HMDB41252 #<Reference:0x000055ce30592078> nutty