3-(Prop-2-yn-1-ylamino)pyrazine-2-carboxylic acid

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CAS1249947-85-0
Purity%
Product CodeF704111
Product Name3-(Prop-2-yn-1-ylamino)pyrazine-2-carboxylic acid
CAS1249947-85-0
Purity95%
Molecular weight177.163
IUPAC Name3-[(prop-2-yn-1-yl)amino]pyrazine-2-carboxylic acid
SMILESOC(=O)C1=NC=CN=C1NCC#C
INCHI CodeInChI=1S/C8H7N3O2/c1-2-3-10-7-6(8(12)13)9-4-5-11-7/h1,4-5H,3H2,(H,10,11)(H,12,13)
Asymmetric atoms0
LogP0.069521435
H bond acceptors5
H bond donors2
fsp30.125
Concept CodesAlkyne, Carboxylic acid, Terminal alkyne, Heterocycle, Heteroaromatic, Secondary amine, Amine (P+S+T), Terminal alkyne (aliphatic hydrocarbon), Terminal alkyne (aromatic hydrocarbon), Terminal alkyne (heteroaromatic), Amino acid, Terminal alkyne (carboxylic acid), Terminal alkyne (amine), 6-Membered heteroaromatic, 6-Membered heterocycle, Pyrazine, Cyclic, Aromatic