Chemical ID: 6664186

c1cc(c(c(c1)Cl)C(=O)c2cc(c(cc2Cl)O)Cl)Cl
Chemical ID:
6664186
Name [?]:
(2,5-dichloro-4-hydroxy-phenyl)-(2,6-dichlorophenyl)-methanone
SMILES [?]:
c1cc(c(c(c1)Cl)C(=O)c2cc(c(cc2Cl)O)Cl)Cl
InChi [?]:
InChI=1/C13H6Cl4O2/c14-7-2-1-3-8(15)12(7)13(19)6-4-10(17)11(18)5-9(6)16/h1-5,18H
InChi Info:
AuxInfo=1/0/N:1,2,6,11,14,10,3,5,15,12,13,4,8,19,7,16,18,17,9/E:(2,3)(7,8)(14,15)/rA:19nCCCCCCClCOCCCCCCClOClCl/rB:s1;d2;s3;d4;d1s5;s5;s4;d8;s8;s10;d11;s12;d13;d10s14;s15;s13;s12;s3;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H6Cl4O2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.89579
Area:475.783
Solvation:-2.9988
Coulombic:-25.6725
Bond Count [?]
All:20
Single:13
Double:7
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:335.996
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.66
LogP (Chemaxon):5.06

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