5446-56-0
8-METHOXY-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-6-CARBOXYLIC ACID
Name
8-METHOXY-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-6-CARBOXYLIC ACID
Formula
C10 H9 N O5
MolWeight
223.183
1Identification
【Name】
8-METHOXY-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-6-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD12033722
【English Synonyms】
【Formula】
C10 H9 N O5
【MolWeight】
223.183
【Inchi】
InChI=1S/C10H9NO5/c1-15-7-3-5(10(13)14)2-6-9(7)16-4-8(12)11-6/h2-3H,4H2,1H3,(H,11,12)(H,13,14)
【InChIKey】
InChIKey=LCWSHJZYFMWNTE-UHFFFAOYSA-N
【SMILES】
COc1cc(cc2c1OCC(=O)N2)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
8-METHOXY-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZINE-6-CARBOXYLIC ACID.cml
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