Chemical ID: 4585044

CCOCCNc1cccc(c1)OC
Chemical ID:
4585044
Name [?]:
N-(2-ethoxyethyl)-3-methoxy-aniline
SMILES [?]:
CCOCCNc1cccc(c1)OC
InChi [?]:
InChI=1/C11H17NO2/c1-3-14-8-7-12-10-5-4-6-11(9-10)13-2/h4-6,9,12H,3,7-8H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,14,2,9,8,10,5,4,12,7,11,6,13,3/rA:14nCCOCCNCCCCCCOC/rB:s1;s2;s3;s4;s5;s6;s7;d8;s9;d10;d7s11;s11;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H17NO2
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:6.03109
Area:400.115
Solvation:-3.97179
Coulombic:-26.8084
Bond Count [?]
All:14
Single:11
Double:3
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:195.258
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.82
LogP (Chemaxon):1.55

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Descriptor Annotations

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