Chemical ID: 4928846

C1CC2CC1c3c2sc(c3F)F
Chemical ID:
4928846
Name [?]:
None
SMILES [?]:
C1CC2CC1c3c2sc(c3F)F
InChi [?]:
InChI=1/C9H8F2S/c10-7-6-4-1-2-5(3-4)8(6)12-9(7)11/h4-5H,1-3H2
InChi Info:
AuxInfo=1/0/N:1,2,4,5,3,6,10,7,9,11,12,8/rA:12cCCCCCCCSCCFF/rB:s1;s2;s3;s1s4;s5;s3d6;s7;s8;s6d9;s10;s9;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H8F2S
All Atoms:12
Heavy Atoms:12
Chiral Atoms:2
ZAP Information [?]
Total:5.89665
Area:304.044
Solvation:-1.70445
Coulombic:-9.10396
Bond Count [?]
All:14
Single:12
Double:2
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:186.223
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.58
LogP (Chemaxon):2.58

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue