Chemical ID: 6418294

C1C2CC3CC1CC(C2)(C3)C(=O)CC(C#N)C#N
Chemical ID:
6418294
Name [?]:
2-[2-(1-adamantyl)-2-oxo-ethyl]propanedinitrile
SMILES [?]:
C1C2CC3CC1CC(C2)(C3)C(=O)CC(C#N)C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H18N2O
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:7.49578
Area:420.306
Solvation:-3.01186
Coulombic:-11.7619
Bond Count [?]
All:20
Single:17
Double:1
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:242.316
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.48
LogP (Chemaxon):3.16

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue