50699-52-0
PHENYL N-(3-NITROPHENYL)CARBAMATE
NamePHENYL N-(3-NITROPHENYL)CARBAMATE
1Identification
【Name】
PHENYL N-(3-NITROPHENYL)CARBAMATE
【CAS】
【MDL】
MFCD00024351
【English Synonyms】
【Formula】
C13 H10 N2 O4
【MolWeight】
258.232
【Inchi】
InChI=1S/C13H10N2O4/c16-13(19-12-7-2-1-3-8-12)14-10-5-4-6-11(9-10)15(17)18/h1-9H,(H,14,16)
【InChIKey】
InChIKey=JRBQTHUEPKJNBD-UHFFFAOYSA-N
【SMILES】
c1ccc(cc1)OC(=O)Nc2cccc(c2)[N+](=O)[O-]
【MOL File】
PHENYL N-(3-NITROPHE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
PHENYL N-(3-NITROPHENYL)CARBAMATE.cml