223423-18-5
METHYL 2-HYDROXY-4-PHENYLPYRIMIDINE-5-CARBOXYLATE
NameMETHYL 2-HYDROXY-4-PHENYLPYRIMIDINE-5-CARBOXYLATE
1Identification
【Name】
METHYL 2-HYDROXY-4-PHENYLPYRIMIDINE-5-CARBOXYLATE
【CAS】
【MDL】
MFCD16660452
【English Synonyms】
【Formula】
C12 H10 N2 O3
【MolWeight】
230.222
【Inchi】
InChI=1S/C12H10N2O3/c1-17-11(15)9-7-13-12(16)14-10(9)8-5-3-2-4-6-8/h2-7H,1H3,(H,13,14,16)
【InChIKey】
InChIKey=BJEWTCAQOSCMCQ-UHFFFAOYSA-N
【SMILES】
COC(=O)c1cnc(nc1c2ccccc2)O
【MOL File】
METHYL 2-HYDROXY-4-P….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METHYL 2-HYDROXY-4-PHENYLPYRIMIDINE-5-CARBOXYLATE.cml