53101-05-6
ETHYL 4-(3-NITROPHENYL)-1,3-THIAZOLE-2-CARBOXYLATE
NameETHYL 4-(3-NITROPHENYL)-1,3-THIAZOLE-2-CARBOXYLATE
1Identification
【Name】
ETHYL 4-(3-NITROPHENYL)-1,3-THIAZOLE-2-CARBOXYLATE
【CAS】
【MDL】
MFCD11976484
【English Synonyms】
【Formula】
C12 H10 N2 O4 S
【MolWeight】
278.287
【Inchi】
InChI=1S/C12H10N2O4S/c1-2-18-12(15)11-13-10(7-19-11)8-4-3-5-9(6-8)14(16)17/h3-7H,2H2,1H3
【InChIKey】
InChIKey=ORZHIBZDQVVYKZ-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1nc(cs1)c2cccc(c2)[N+](=O)[O-]
【MOL File】
ETHYL 4-(3-NITROPHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 4-(3-NITROPHENYL)-1,3-THIAZOLE-2-CARBOXYLATE.cml