1.0 2010-04-08 22:05:33 UTC 2020-02-24 19:10:39 UTC FDB002871 1,4-Dimethylpyrrolo[1,2-a]pyrazine Component of roast beef aroma. 1,4-Dimethylpyrrolo[1,2-a]pyrazine is found in animal foods. C9H10N2 146.1891 146.08439833 1,4-dimethylpyrrolo[1,2-a]pyrazine 1,4-dimethylpyrrolo[1,2-a]pyrazine 64608-63-5 CC1=CN=C(C)C2=CC=CN12 InChI=1S/C9H10N2/c1-7-6-10-8(2)9-4-3-5-11(7)9/h3-6H,1-2H3 FRKUPFZWTZZLGN-UHFFFAOYSA-N belongs to the class of organic compounds known as pyrrolopyrazines. Pyrrolopyrazines are compounds containing a pyrrolopyrazine moiety, which consists of a pyrrole ring fused to a pyrazine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrazine is a 6-membered ring consisting of six carbon atoms and two nitrogen centers at ring positions 1 and 4. Pyrrolopyrazines Organic compounds Organoheterocyclic compounds Pyrrolopyrazines Aromatic heteropolycyclic compounds Azacyclic compounds Heteroaromatic compounds Hydrocarbon derivatives Organonitrogen compounds Organopnictogen compounds Pyrazines Pyrroles Aromatic heteropolycyclic compound Azacycle Heteroaromatic compound Hydrocarbon derivative Organic nitrogen compound Organonitrogen compound Organopnictogen compound Pyrazine Pyrrole Pyrrolopyrazine logp 1.57 ALOGPS logs -1.32 ALOGPS solubility 7.00e+00 g/l ALOGPS logp 0.72 ChemAxon pka_strongest_basic 0.16 ChemAxon iupac 1,4-dimethylpyrrolo[1,2-a]pyrazine ChemAxon average_mass 146.1891 ChemAxon mono_mass 146.08439833 ChemAxon smiles CC1=CN=C(C)C2=CC=CN12 ChemAxon formula C9H10N2 ChemAxon inchi InChI=1S/C9H10N2/c1-7-6-10-8(2)9-4-3-5-11(7)9/h3-6H,1-2H3 ChemAxon inchikey FRKUPFZWTZZLGN-UHFFFAOYSA-N ChemAxon polar_surface_area 17.3 ChemAxon refractivity 45.72 ChemAxon polarizability 16.3 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 1 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsIr 4014 Specdb::MsIr 4015 Specdb::CMs 12028 Specdb::CMs 158050 Specdb::NmrOneD 110718 Specdb::NmrOneD 110719 Specdb::NmrOneD 110720 Specdb::NmrOneD 110721 Specdb::NmrOneD 110722 Specdb::NmrOneD 110723 Specdb::NmrOneD 110724 Specdb::NmrOneD 110725 Specdb::NmrOneD 110726 Specdb::NmrOneD 110727 Specdb::NmrOneD 110728 Specdb::NmrOneD 110729 Specdb::NmrOneD 110730 Specdb::NmrOneD 110731 Specdb::NmrOneD 110732 Specdb::NmrOneD 110733 Specdb::NmrOneD 110734 Specdb::NmrOneD 110735 Specdb::NmrOneD 110736 Specdb::NmrOneD 110737 Specdb::MsMs 59601 Specdb::MsMs 59602 Specdb::MsMs 59603 Specdb::MsMs 115767 Specdb::MsMs 115768 Specdb::MsMs 115769 Specdb::MsMs 2738152 Specdb::MsMs 2738153 Specdb::MsMs 2738154 Specdb::MsMs 2970693 Specdb::MsMs 2970694 Specdb::MsMs 2970695 HMDB30906 #<Reference:0x000055ce31d133f0>