Chemical ID: 5147277

CCCCCC(CCC(=O)C)C(=O)O
Chemical ID:
5147277
Name [?]:
2-(3-oxobutyl)heptanoic acid
SMILES [?]:
CCCCCC(CCC(=O)C)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H20O3
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:7.59529
Area:412.497
Solvation:-2.71714
Coulombic:-33.4356
Bond Count [?]
All:13
Single:11
Double:2
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:200.275
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:2.48
LogP (Chemaxon):2.72

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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