Chemical ID: 5620619

CC1Cc2cc(c(cc2O1)C#N)OC
Chemical ID:
5620619
Name [?]:
5-methoxy-2-methyl-2,3-dihydrobenzofuran-6-carbonitrile
SMILES [?]:
CC1Cc2cc(c(cc2O1)C#N)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H11NO2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:5.57305
Area:361.715
Solvation:-3.46983
Coulombic:-17.3621
Bond Count [?]
All:15
Single:11
Double:3
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:189.211
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.88
LogP (Chemaxon):1.75

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