Chemical ID: 5239173

CCC(c1ccncc1C)C(=O)OCC
Chemical ID:
5239173
Name [?]:
ethyl 2-(3-methyl-4-pyridyl)butanoate
SMILES [?]:
CCC(c1ccncc1C)C(=O)OCC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H17NO2
All Atoms:15
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:7.6051
Area:395.251
Solvation:-2.27618
Coulombic:-23.42
Bond Count [?]
All:15
Single:11
Double:4
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:207.269
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.95
LogP (Chemaxon):2.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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