Chemical ID: 5574861

CC#CC(=O)COCC(=CC=C)C
Chemical ID:
5574861
Name [?]:
1-(2-methylpenta-2,4-dienoxy)pent-3-yn-2-one
SMILES [?]:
CC#CC(=O)COCC(=CC=C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H14O2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.38926
Area:411.312
Solvation:-3.89355
Coulombic:-18.5294
Bond Count [?]
All:12
Single:8
Double:3
Rotors:5
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:178.228
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.66
LogP (Chemaxon):2.53

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