Chemical ID: 3990098

CCOc1ccccc1OCCC(=O)O
Chemical ID:
3990098
Name [?]:
3-(2-ethoxyphenoxy)propanoic acid
SMILES [?]:
CCOc1ccccc1OCCC(=O)O
InChi [?]:
InChI=1/C11H14O4/c1-2-14-9-5-3-4-6-10(9)15-8-7-11(12)13/h3-6H,2,7-8H2,1H3,(H,12,13)
InChi Info:
AuxInfo=1/1/N:1,2,6,7,5,8,12,11,4,9,13,14,15,3,10/E:(12,13)/rA:15nCCOCCCCCCOCCCOO/rB:s1;s2;s3;s4;d5;s6;d7;d4s8;s9;s10;s11;s12;d13;s13;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H14O4
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:5.67599
Area:404.108
Solvation:-4.42671
Coulombic:-40.9322
Bond Count [?]
All:15
Single:11
Double:4
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:210.226
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.55
LogP (Chemaxon):1.61

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