914605-77-9
4-(3-NITROPHENOXY)-BUTANOIC ACID, METHYL ESTER
Name4-(3-NITROPHENOXY)-BUTANOIC ACID, METHYL ESTER
1Identification
【Name】
4-(3-NITROPHENOXY)-BUTANOIC ACID, METHYL ESTER
【CAS】
【MDL】
MFCD12410046
【English Synonyms】
【Formula】
C11 H13 N O5
【MolWeight】
239.226
【Inchi】
InChI=1S/C11H13NO5/c1-16-11(13)6-3-7-17-10-5-2-4-9(8-10)12(14)15/h2,4-5,8H,3,6-7H2,1H3
【InChIKey】
InChIKey=OXKQRXUDMCYHBP-UHFFFAOYSA-N
【SMILES】
COC(=O)CCCOc1cccc(c1)[N+](=O)[O-]
【MOL File】
4-(3-NITROPHENOXY)-B….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
4-(3-NITROPHENOXY)-BUTANOIC ACID, METHYL ESTER.cml