883977-21-7
BENZENEMETHANAMINE, N-CYCLOPROPYL-3-METHYL-5-NITRO-
NameBENZENEMETHANAMINE, N-CYCLOPROPYL-3-METHYL-5-NITRO-
1Identification
【Name】
BENZENEMETHANAMINE, N-CYCLOPROPYL-3-METHYL-5-NITRO-
【CAS】
【MDL】
MFCD17171105
【English Synonyms】
【Formula】
C11 H14 N2 O2
【MolWeight】
206.244
【Inchi】
InChI=1S/C11H14N2O2/c1-8-4-9(7-12-10-2-3-10)6-11(5-8)13(14)15/h4-6,10,12H,2-3,7H2,1H3
【InChIKey】
InChIKey=OZNJPDRBTFJELI-UHFFFAOYSA-N
【SMILES】
Cc1cc(cc(c1)[N+](=O)[O-])CNC2CC2
【MOL File】
BENZENEMETHANAMINE, ….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BENZENEMETHANAMINE, N-CYCLOPROPYL-3-METHYL-5-NITRO-.cml