MLS000589313

9-imino-12-propyl-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile

Also Known As: 2-imino-10-propyltetrahydro-8a,3-(epoxymethano)chromene-3,4,4(2H,4aH)-tricarbonitrile|SR-01000710828-2|9-Imino-12-propyl-10,11-dioxatricyclo[6.2.2.01,6]dodecane-7,7,8-tricarbonitrile|2-imino-10-propylhexahydro-8a,3-(epoxymethano)chromene-3,4,4(4aH)-tricarbonitrile|9-Imino-12-propyl-10,11-dioxa-tricyclo[6.2.2.0*1,6*]dodecane-7,7,8-tricarbonitrile

Molecular Formula	C16H18N4O2
Molecular Weight	298.14297 g/mol
LogP	2.62281
Topological Polar Surface Area	113.68 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	2
Exact Mass	298.14297
Monoisotopic Mass	298.14297
Heavy Atoms	22
Complexity	626.0019

Chemical Identifiers

CAS Number	95059-23-7
SMILES	CCCC1C2(C(=N)OC3(O1)CCCCC3C2(C#N)C#N)C#N