933988-81-9
4-METHYL-2-(PYRIDIN-3-YL)PYRIMIDINE-5-CARBOXYLIC ACID
Name4-METHYL-2-(PYRIDIN-3-YL)PYRIMIDINE-5-CARBOXYLIC ACID
1Identification
【Name】
4-METHYL-2-(PYRIDIN-3-YL)PYRIMIDINE-5-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD13188570
【English Synonyms】
【Formula】
C11 H9 N3 O2
【MolWeight】
215.211
【Inchi】
InChI=1S/C11H9N3O2/c1-7-9(11(15)16)6-13-10(14-7)8-3-2-4-12-5-8/h2-6H,1H3,(H,15,16)
【InChIKey】
InChIKey=LWBPSVFSYUOCOS-UHFFFAOYSA-N
【SMILES】
Cc1c(cnc(n1)c2cccnc2)C(=O)O
【MOL File】
4-METHYL-2-(PYRIDIN-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-METHYL-2-(PYRIDIN-3-YL)PYRIMIDINE-5-CARBOXYLIC ACID.cml