Chemical ID: 6376263

CCNC(=O)COc1ccc(cc1C)Cl
Chemical ID:
6376263
Name [?]:
2-(4-chloro-2-methyl-phenoxy)-N-ethyl-acetamide
SMILES [?]:
CCNC(=O)COc1ccc(cc1C)Cl
InChi [?]:
InChI=1/C11H14ClNO2/c1-3-13-11(14)7-15-10-5-4-9(12)6-8(10)2/h4-6H,3,7H2,1-2H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,14,2,10,9,12,6,13,11,8,4,15,3,5,7/rA:15nCCNCOCOCCCCCCCCl/rB:s1;s2;s3;d4;s4;s6;s7;s8;d9;s10;d11;d8s12;s13;s11;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H14ClNO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.04166
Area:425.006
Solvation:-3.5835
Coulombic:-28.8032
Bond Count [?]
All:15
Single:11
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:227.687
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.38
LogP (Chemaxon):2.05

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