Chemical ID: 5126345

CCc1ccc(o1)C(=O)C
Chemical ID:
5126345
Name [?]:
1-(5-ethyl-2-furyl)ethanone
SMILES [?]:
CCc1ccc(o1)C(=O)C
InChi [?]:
InChI=1/C8H10O2/c1-3-7-4-5-8(10-7)6(2)9/h4-5H,3H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,10,2,4,5,8,3,6,9,7/rA:10nCCCCCCOCOC/rB:s1;s2;d3;s4;d5;s3s6;s6;d8;s8;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H10O2
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.86479
Area:305.934
Solvation:-1.78355
Coulombic:-15.7184
Bond Count [?]
All:10
Single:7
Double:3
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:138.164
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.05
LogP (Chemaxon):0.79

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