Chemical ID: 3997968

CCc1ccccc1NC(=O)CCl
Chemical ID:
3997968
Name [?]:
2-chloro-N-(2-ethylphenyl)-acetamide
SMILES [?]:
CCc1ccccc1NC(=O)CCl
InChi [?]:
InChI=1/C10H12ClNO/c1-2-8-5-3-4-6-9(8)12-10(13)7-11/h3-6H,2,7H2,1H3,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,2,5,6,4,7,12,3,8,10,13,9,11/rA:13nCCCCCCCCNCOCCl/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;s9;d10;s10;s12;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H12ClNO
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:6.91772
Area:371.579
Solvation:-2.37176
Coulombic:-20.8801
Bond Count [?]
All:13
Single:9
Double:4
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:197.661
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.2
LogP (Chemaxon):2.18

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Descriptor Annotations

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