545394-98-7
METHYL 1,2,3,4-TETRAHYDRO-7-NITRO-2-OXOQUINOLINE-3-CARBOXYLATE
NameMETHYL 1,2,3,4-TETRAHYDRO-7-NITRO-2-OXOQUINOLINE-3-CARBOXYLATE
1Identification
【Name】
METHYL 1,2,3,4-TETRAHYDRO-7-NITRO-2-OXOQUINOLINE-3-CARBOXYLATE
【CAS】
【MDL】
MFCD09264066
【English Synonyms】
【Formula】
C11 H10 N2 O5
【MolWeight】
250.209
【Inchi】
InChI=1S/C11H10N2O5/c1-18-11(15)8-4-6-2-3-7(13(16)17)5-9(6)12-10(8)14/h2-3,5,8H,4H2,1H3,(H,12,14)
【InChIKey】
InChIKey=QDDCSOGWKDGHKK-UHFFFAOYSA-N
【SMILES】
COC(=O)C1Cc2ccc(cc2NC1=O)[N+](=O)[O-]
【MOL File】
METHYL 1,2,3,4-TETRA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:1.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
METHYL 1,2,3,4-TETRAHYDRO-7-NITRO-2-OXOQUINOLINE-3-CARBOXYLATE.cml