Chemical ID: 4686755

CCOC(=O)C(C)C(=O)c1ccc(cc1)C
Chemical ID:
4686755
Name [?]:
ethyl 2-methyl-3-oxo-3-(p-tolyl)propanoate
SMILES [?]:
CCOC(=O)C(C)C(=O)c1ccc(cc1)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H16O3
All Atoms:16
Heavy Atoms:16
Chiral Atoms:1
ZAP Information [?]
Total:7.20797
Area:419.408
Solvation:-3.27724
Coulombic:-26.0852
Bond Count [?]
All:16
Single:11
Double:5
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:220.264
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.04
LogP (Chemaxon):2.62

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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