744175-78-8
2-(AMINOMETHYL)-1,4,5,6-TETRAHYDRO-4-PYRIMIDINECARBOXYLIC ACID
Name2-(AMINOMETHYL)-1,4,5,6-TETRAHYDRO-4-PYRIMIDINECARBOXYLIC ACID
1Identification
【Name】
2-(AMINOMETHYL)-1,4,5,6-TETRAHYDRO-4-PYRIMIDINECARBOXYLIC ACID
【CAS】
【MDL】
MFCD13175043
【English Synonyms】
【Formula】
C6 H11 N3 O2
【MolWeight】
157.172
【Inchi】
InChI=1S/C6H11N3O2/c7-3-5-8-2-1-4(9-5)6(10)11/h4H,1-3,7H2,(H,8,9)(H,10,11)
【InChIKey】
InChIKey=FXPVXLLICWGRGN-UHFFFAOYSA-N
【SMILES】
C1CNC(=NC1C(=O)O)CN
【MOL File】
2-(AMINOMETHYL)-1,4,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:-4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-(AMINOMETHYL)-1,4,5,6-TETRAHYDRO-4-PYRIMIDINECARBOXYLIC ACID.cml