519032-06-5
5,6-DIHYDROXY-2-P-TOLYL-PYRIMIDINE-4-CARBOXYLIC ACID METHYL ESTER
Name5,6-DIHYDROXY-2-P-TOLYL-PYRIMIDINE-4-CARBOXYLIC ACID METHYL ESTER
1Identification
【Name】
5,6-DIHYDROXY-2-P-TOLYL-PYRIMIDINE-4-CARBOXYLIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD04974513
【English Synonyms】
【Formula】
C13 H12 N2 O4
【MolWeight】
260.248
【Inchi】
InChI=1S/C13H12N2O4/c1-7-3-5-8(6-4-7)11-14-9(13(18)19-2)10(16)12(17)15-11/h3-6,16H,1-2H3,(H,14,15,17)
【InChIKey】
InChIKey=HFIKCGNMVHHDRP-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1)c2nc(c(c(n2)O)O)C(=O)OC
【MOL File】
5,6-DIHYDROXY-2-P-TO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5,6-DIHYDROXY-2-P-TOLYL-PYRIMIDINE-4-CARBOXYLIC ACID METHYL ESTER.cml