Chemical ID: 6398138

c1cc(c(c(c1)Cl)NC(=O)CCl)Cl
Chemical ID:
6398138
Name [?]:
2-chloro-N-(2,6-dichlorophenyl)-acetamide
SMILES [?]:
c1cc(c(c(c1)Cl)NC(=O)CCl)Cl
InChi [?]:
InChI=1/C8H6Cl3NO/c9-4-7(13)12-8-5(10)2-1-3-6(8)11/h1-3H,4H2,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,2,6,11,3,5,9,4,12,13,7,8,10/E:(2,3)(5,6)(10,11)/rA:13nCCCCCCClNCOCClCl/rB:s1;d2;s3;d4;d1s5;s5;s4;s8;d9;s9;s11;s3;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H6Cl3NO
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:7.13375
Area:385.189
Solvation:-2.49597
Coulombic:-21.1568
Bond Count [?]
All:13
Single:9
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:238.497
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.76
LogP (Chemaxon):1.7

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