Chemical ID: 4224709

c1cc(c(c(c1)Cl)OCCN2CCCCC2)Cl
Chemical ID:
4224709
Name [?]:
1-[2-(2,6-dichlorophenoxy)ethyl]piperidine
SMILES [?]:
c1cc(c(c(c1)Cl)OCCN2CCCCC2)Cl
InChi [?]:
InChI=1/C13H17Cl2NO/c14-11-5-4-6-12(15)13(11)17-10-9-16-7-2-1-3-8-16/h4-6H,1-3,7-10H2
InChi Info:
AuxInfo=1/0/N:14,13,15,1,2,6,12,16,10,9,3,5,4,17,7,11,8/E:(2,3)(5,6)(7,8)(11,12)(14,15)/rA:17nCCCCCCClOCCNCCCCCCl/rB:s1;d2;s3;d4;d1s5;s5;s4;s8;s9;s10;s11;s12;s13;s14;s11s15;s3;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H17Cl2NO
All Atoms:17
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:8.23249
Area:435.105
Solvation:-2.64513
Coulombic:-14.2621
Bond Count [?]
All:18
Single:15
Double:3
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:274.186
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.9
LogP (Chemaxon):3.53

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