897375-22-3
4-CHLORO-2-(1,1-DIMETHYLETHYL)-5-PYRIMIDINECARBOXYLIC ACID METHYL ESTER
Name4-CHLORO-2-(1,1-DIMETHYLETHYL)-5-PYRIMIDINECARBOXYLIC ACID METHYL ESTER
1Identification
【Name】
4-CHLORO-2-(1,1-DIMETHYLETHYL)-5-PYRIMIDINECARBOXYLIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD17169934
【English Synonyms】
【Formula】
C10 H13 Cl N2 O2
【MolWeight】
228.678
【Inchi】
InChI=1S/C10H13ClN2O2/c1-10(2,3)9-12-5-6(7(11)13-9)8(14)15-4/h5H,1-4H3
【InChIKey】
InChIKey=APURDRCSFCEZAJ-UHFFFAOYSA-N
【SMILES】
CC(C)(C)c1ncc(c(n1)Cl)C(=O)OC
【MOL File】
4-CHLORO-2-(1,1-DIME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-CHLORO-2-(1,1-DIMETHYLETHYL)-5-PYRIMIDINECARBOXYLIC ACID METHYL ESTER.cml