Chemical ID: 6423085

Cn1cccc(c1=S)Cl
Chemical ID:
6423085
Name [?]:
3-chloro-1-methyl-pyridine-2-thione
SMILES [?]:
Cn1cccc(c1=S)Cl
InChi [?]:
InChI=1/C6H6ClNS/c1-8-4-2-3-5(7)6(8)9/h2-4H,1H3
InChi Info:
AuxInfo=1/0/N:1,4,5,3,6,7,9,2,8/rA:9nCNCCCCCSCl/rB:s1;s2;d3;s4;d5;s2s6;d7;s6;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H6ClNS
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:6.65867
Area:296.045
Solvation:-0.74246
Coulombic:-8.21853
Bond Count [?]
All:9
Single:6
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:159.637
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.62
LogP (Chemaxon):2.04

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Descriptor Annotations

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