730949-68-5
METHYL 2-(CHLOROMETHYL)-4-OXO-3,4-DIHYDROQUINAZOLINE-7-CARBOXYLATE
NameMETHYL 2-(CHLOROMETHYL)-4-OXO-3,4-DIHYDROQUINAZOLINE-7-CARBOXYLATE
1Identification
【Name】
METHYL 2-(CHLOROMETHYL)-4-OXO-3,4-DIHYDROQUINAZOLINE-7-CARBOXYLATE
【CAS】
【MDL】
MFCD04621457
【English Synonyms】
【Formula】
C11 H9 Cl N2 O3
【MolWeight】
252.656
【Inchi】
InChI=1S/C11H9ClN2O3/c1-17-11(16)6-2-3-7-8(4-6)13-9(5-12)14-10(7)15/h2-4H,5H2,1H3,(H,13,14,15)
【InChIKey】
InChIKey=AKOLVCTUEUWOIR-UHFFFAOYSA-N
【SMILES】
COC(=O)c1ccc2c(c1)nc([nH]c2=O)CCl
【MOL File】
METHYL 2-(CHLOROMETH….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-(CHLOROMETHYL)-4-OXO-3,4-DIHYDROQUINAZOLINE-7-CARBOXYLATE.cml