AC1MCDX2

1'-[2,6-dinitro-4-(trifluoromethyl)phenyl]spiro[3a,4,8,8a-tetrahydro-[1,3]dioxepino[5,6-d][1,2]oxazole-6,4'-piperidine]-3-carbohydrazide

Also Known As: KS-00002Z9K|11H-926|1'-[2,6-dinitro-4-(trifluoromethyl)phenyl]spiro[3a,4,8,8a-tetrahydro-[1,3]dioxepino[5,6-d][1,2]oxazole-6,4'-piperidine]-3-carbohydrazide|4,5-Bis(hydroxymethyl)-3-hydrazido-4,5-dihydroisoxazole-1(2,6-dinitro-4-trifluoromethylphenyl)piperid-4-one acetal|1'-[2,6-dinitro-4-(trifluoromethyl)phenyl]-3a,4,8,8a-tetrahydrospiro[[1,3]dioxepino[5,6-d][1,2]oxazole-6,4'-piperidine]-3-carbohydrazide

Molecular Formula	C18H19F3N6O8
Molecular Weight	504.12164 g/mol
LogP	1.226
Topological Polar Surface Area	184.69 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	11
Rotatable Bonds	4
Exact Mass	504.12164
Monoisotopic Mass	504.12164
Heavy Atoms	35
Complexity	1053.4836

Chemical Identifiers

CAS Number	303153-01-7
SMILES	C1CN(CCC12OCC3C(CO2)ON=C3C(=O)NN)C4=C(C=C(C=C4[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]