Chemical ID: 4477410

COc1cc(c(cc1OC)Cl)C=C(C#N)c2ccc(cc2)Cl
Chemical ID:
4477410
Name [?]:
3-(2-chloro-4,5-dimethoxy-phenyl)-2-(4-chlorophenyl)-prop-2-enenitrile
SMILES [?]:
COc1cc(c(cc1OC)Cl)C=C(C#N)c2ccc(cc2)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H13Cl2NO2
All Atoms:22
Heavy Atoms:22
Chiral Atoms:0
ZAP Information [?]
Total:8.57887
Area:527.758
Solvation:-4.61508
Coulombic:-19.7612
Bond Count [?]
All:23
Single:15
Double:7
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:334.196
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.68
LogP (Chemaxon):4.52

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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