3-(Prop-2-yn-1-ylamino)pyrazine-2-carboxylic acid
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Product Code | F704111 |
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Product Name | 3-(Prop-2-yn-1-ylamino)pyrazine-2-carboxylic acid |
CAS | 1249947-85-0 |
Purity | 95% |
Molecular weight | 177.163 |
IUPAC Name | 3-[(prop-2-yn-1-yl)amino]pyrazine-2-carboxylic acid |
SMILES | OC(=O)C1=NC=CN=C1NCC#C |
INCHI Code | InChI=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 atoms | 0 |
LogP | 0.069521435 |
H bond acceptors | 5 |
H bond donors | 2 |
fsp3 | 0.125 |
Concept Codes | Alkyne, 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 |