N-[(3Z)-4,7,7-tricyano-1,5,5-trimethyl-2-oxabicyclo[2.2.1]heptan-3-ylidene]hypobromous amide
Chemical Structure Depiction of
N-[(3Z)-4,7,7-tricyano-1,5,5-trimethyl-2-oxabicyclo[2.2.1]heptan-3-ylidene]hypobromous amide
N-[(3Z)-4,7,7-tricyano-1,5,5-trimethyl-2-oxabicyclo[2.2.1]heptan-3-ylidene]hypobromous amide
Compound characteristics
Compound ID: | 8009-4089 |
Compound Name: | N-[(3Z)-4,7,7-tricyano-1,5,5-trimethyl-2-oxabicyclo[2.2.1]heptan-3-ylidene]hypobromous amide |
Molecular Weight: | 307.15 |
Molecular Formula: | C12 H11 Br N4 O |
Smiles: | CC1(C)CC2(C)C(C#N)(C#N)C1(C#N)/C(=N/[Br])O2 |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.2088 |
logD: | 2.2038 |
logSw: | -1.7971 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 67.469 |
InChI Key: | JFULWUISSJWHMS-UHFFFAOYSA-N |