Chemical ID: 4556590

COc1ccc(cc1OC)C2(CCC(CC2)O)C#N
Chemical ID:
4556590
Name [?]:
1-(3,4-dimethoxyphenyl)-4-hydroxy-cyclohexane-1-carbonitrile
SMILES [?]:
COc1ccc(cc1OC)C2(CCC(CC2)O)C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C15H19NO3
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:5.02066
Area:447.06
Solvation:-6.15584
Coulombic:-33.6514
Bond Count [?]
All:20
Single:16
Double:3
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:261.316
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.75
LogP (Chemaxon):2.36

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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