Chemical ID: 7061735

c1ccc(c(c1)OCCCN2CCOCC2)Cl
Chemical ID:
7061735
Name [?]:
4-[3-(2-chlorophenoxy)propyl]morpholine
SMILES [?]:
c1ccc(c(c1)OCCCN2CCOCC2)Cl
InChi [?]:
InChI=1/C13H18ClNO2/c14-12-4-1-2-5-13(12)17-9-3-6-15-7-10-16-11-8-15/h1-2,4-5H,3,6-11H2
InChi Info:
AuxInfo=1/0/N:2,1,9,3,6,10,12,16,8,13,15,4,5,17,11,14,7/E:(7,8)(10,11)/rA:17nCCCCCCOCCCNCCOCCCl/rB:s1;d2;s3;d4;d1s5;s5;s7;s8;s9;s10;s11;s12;s13;s14;s11s15;s4;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H18ClNO2
All Atoms:35
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:7.55083
Area:454.374
Solvation:-3.80853
Coulombic:-21.8848
Bond Count [?]
All:18
Single:15
Double:3
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:255.74
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.37
LogP (Chemaxon):2.0

Name Annotations

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Descriptor Annotations

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