Chemical ID: 6688719

CCOCCCC(=O)OCC
Chemical ID:
6688719
Name [?]:
ethyl 4-ethoxybutanoate
SMILES [?]:
CCOCCCC(=O)OCC
InChi [?]:
InChI=1/C8H16O3/c1-3-10-7-5-6-8(9)11-4-2/h3-7H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,11,2,10,5,6,4,7,8,3,9/rA:11nCCOCCCCOOCC/rB:s1;s2;s3;s4;s5;s6;d7;s7;s9;s10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H16O3
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:5.92487
Area:366.035
Solvation:-3.226
Coulombic:-25.191
Bond Count [?]
All:10
Single:9
Double:1
Rotors:7
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:160.211
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:1.09
LogP (Chemaxon):0.7

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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