Chemical ID: 6914051

C(CC(=O)C(=O)O)C=O
Chemical ID:
6914051
Name [?]:
2,5-dioxopentanoic acid
SMILES [?]:
C(CC(=O)C(=O)O)C=O
InChi [?]:
InChI=1/C5H6O4/c6-3-1-2-4(7)5(8)9/h3H,1-2H2,(H,8,9)
InChi Info:
AuxInfo=1/1/N:1,2,8,3,5,9,4,6,7/E:(8,9)/rA:9nCCCOCOOCO/rB:s1;s2;d3;s3;d5;s5;s1;d8;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C5H6O4
All Atoms:15
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:3.30393
Area:293.689
Solvation:-4.03829
Coulombic:-40.8561
Bond Count [?]
All:8
Single:5
Double:3
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:130.099
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:-0.68
LogP (Chemaxon):-0.31

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Descriptor Annotations

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