Chemical ID: 4735047

c1cc(ccc1OCCC#N)Cl
Chemical ID:
4735047
Name [?]:
3-(4-chlorophenoxy)propanenitrile
SMILES [?]:
c1cc(ccc1OCCC#N)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C9H8ClNO
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.90852
Area:367.371
Solvation:-2.27575
Coulombic:-10.797
Bond Count [?]
All:12
Single:8
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:181.619
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.21
LogP (Chemaxon):2.37

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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