886498-04-0
2-OXO-4-P-TOLYL-2,3-DIHYDRO-THIAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
Name2-OXO-4-P-TOLYL-2,3-DIHYDRO-THIAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
1Identification
【Name】
2-OXO-4-P-TOLYL-2,3-DIHYDRO-THIAZOLE-5-CARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD06740424
【English Synonyms】
【Formula】
C13 H13 N O3 S
【MolWeight】
263.316
【Inchi】
InChI=1S/C13H13NO3S/c1-3-17-12(15)11-10(14-13(16)18-11)9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H,14,16)
【InChIKey】
InChIKey=PCFOOWJIQROZKM-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c([nH]c(=O)s1)c2ccc(cc2)C
【MOL File】
2-OXO-4-P-TOLYL-2,3-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-OXO-4-P-TOLYL-2,3-DIHYDRO-THIAZOLE-5-CARBOXYLIC ACID ETHYL ESTER.cml