Chemical ID: 4272692

CC(c1ccccc1)NC(=O)CC(=O)C
Chemical ID:
4272692
Name [?]:
3-oxo-N-(1-phenylethyl)butanamide
SMILES [?]:
CC(c1ccccc1)NC(=O)CC(=O)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H15NO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:5.55794
Area:399.008
Solvation:-4.41726
Coulombic:-25.5041
Bond Count [?]
All:15
Single:10
Double:5
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:205.253
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.99
LogP (Chemaxon):1.81

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