Chemical ID: 4676606

c1cc(c(cc1NCCC#N)Cl)Cl
Chemical ID:
4676606
Name [?]:
3-(3,4-dichlorophenyl)aminopropanenitrile
SMILES [?]:
c1cc(c(cc1NCCC#N)Cl)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C9H8Cl2N2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:8.30555
Area:400.518
Solvation:-1.7074
Coulombic:-15.0122
Bond Count [?]
All:13
Single:9
Double:3
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:215.079
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.99
LogP (Chemaxon):2.72

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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