Chemical ID: 6683258

c1cc(cc(c1)Cl)O
Chemical ID:
6683258
Name [?]:
3-chlorophenol
SMILES [?]:
c1cc(cc(c1)Cl)O
InChi [?]:
InChI=1/C6H5ClO/c7-5-2-1-3-6(8)4-5/h1-4,8H
InChi Info:
AuxInfo=1/0/N:1,6,2,4,5,3,7,8/rA:8nCCCCCCClO/rB:s1;d2;s3;d4;d1s5;s5;s3;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C6H5ClO
All Atoms:8
Heavy Atoms:8
Chiral Atoms:0
ZAP Information [?]
Total:5.4232
Area:271.012
Solvation:-1.35211
Coulombic:-17.4484
Bond Count [?]
All:8
Single:5
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:128.556
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.24
LogP (Chemaxon):2.28

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