Chemical ID: 7088848

c1c(cc(cc1F)S)F
Chemical ID:
7088848
Name [?]:
3,5-difluorobenzenethiol
SMILES [?]:
c1c(cc(cc1F)S)F
InChi [?]:
InChI=1/C6H4F2S/c7-4-1-5(8)3-6(9)2-4/h1-3,9H
InChi Info:
AuxInfo=1/0/N:1,3,5,2,6,4,9,7,8/E:(2,3)(4,5)(7,8)/rA:9nCCCCCCFSF/rB:s1;d2;s3;d4;d1s5;s6;s4;s2;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H4F2S
All Atoms:13
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:4.41978
Area:268.91
Solvation:-2.30296
Coulombic:-9.08883
Bond Count [?]
All:9
Single:6
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:146.159
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.72
LogP (Chemaxon):2.41

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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