Chemical ID: 4414092

C=CCc1ccccc1OCCNCCO
Chemical ID:
4414092
Name [?]:
2-[2-(2-allylphenoxy)ethylamino]ethanol
SMILES [?]:
C=CCc1ccccc1OCCNCCO
InChi [?]:
InChI=1/C13H19NO2/c1-2-5-12-6-3-4-7-13(12)16-11-9-14-8-10-15/h2-4,6-7,14-15H,1,5,8-11H2
InChi Info:
AuxInfo=1/0/N:1,2,6,7,3,5,8,14,12,15,11,4,9,13,16,10/rA:16nCCCCCCCCCOCCNCCO/rB:d1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s11;s12;s13;s14;s15;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H19NO2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.14675
Area:441.432
Solvation:-3.88905
Coulombic:-34.9156
Bond Count [?]
All:16
Single:12
Double:4
Rotors:8
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:221.296
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.92
LogP (Chemaxon):2.01

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