59115-08-1
2-METHYL-2-(4-NITROPHENYL)PROPIONIC ACID METHYL ESTER
Name2-METHYL-2-(4-NITROPHENYL)PROPIONIC ACID METHYL ESTER
1Identification
【Name】
2-METHYL-2-(4-NITROPHENYL)PROPIONIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD20484143
【English Synonyms】
【Formula】
C11 H13 N O4
【MolWeight】
223.227
【Inchi】
InChI=1S/C11H13NO4/c1-11(2,10(13)16-3)8-4-6-9(7-5-8)12(14)15/h4-7H,1-3H3
【InChIKey】
InChIKey=HSQIFLIPJUZWEO-UHFFFAOYSA-N
【SMILES】
CC(C)(c1ccc(cc1)[N+](=O)[O-])C(=O)OC
【MOL File】
2-METHYL-2-(4-NITROP….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-METHYL-2-(4-NITROPHENYL)PROPIONIC ACID METHYL ESTER.cml