Chemical ID: 3964458

c1cnc(cc1C#N)Cl
Chemical ID:
3964458
Name [?]:
2-chloropyridine-4-carbonitrile
SMILES [?]:
c1cnc(cc1C#N)Cl
InChi [?]:
InChI=1/C6H3ClN2/c7-6-3-5(4-8)1-2-9-6/h1-3H
InChi Info:
AuxInfo=1/0/N:1,2,5,7,6,4,9,8,3/rA:9nCCNCCCCNCl/rB:s1;d2;s3;d4;d1s5;s6;t7;s4;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H3ClN2
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:5.91937
Area:295.631
Solvation:-1.4714
Coulombic:-8.53325
Bond Count [?]
All:9
Single:5
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:138.554
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.2
LogP (Chemaxon):1.44

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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