Chemical ID: 6340631

Cc1ccccc1NC(=O)CCCCl
Chemical ID:
6340631
Name [?]:
4-chloro-N-(o-tolyl)butanamide
SMILES [?]:
Cc1ccccc1NC(=O)CCCCl
InChi [?]:
InChI=1/C11H14ClNO/c1-9-5-2-3-6-10(9)13-11(14)7-4-8-12/h2-3,5-6H,4,7-8H2,1H3,(H,13,14)
InChi Info:
AuxInfo=1/1/N:1,4,5,12,3,6,11,13,2,7,9,14,8,10/rA:14nCCCCCCCNCOCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;d9;s9;s11;s12;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H14ClNO
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.78786
Area:402.909
Solvation:-2.28486
Coulombic:-20.6918
Bond Count [?]
All:14
Single:10
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:211.688
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:2.46
LogP (Chemaxon):2.21

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