Chemical ID: 5247902

C(C(C(=O)[OH2+])O)(C(=O)[OH2+])O
Chemical ID:
5247902
Name [?]:
(2,3-dihydroxy-3-oxoniocarbonyl-propanoyl)oxonium
SMILES [?]:
C(C(C(=O)[OH2+])O)(C(=O)[OH2+])O
InChi [?]:
InChI=1/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/p+2
InChi Info:
AuxInfo=1/1/N:1,2,7,3,10,6,8,9,4,5/E:(1,2)(3,4)(5,6)(7,8,9,10)/gE:(1,2)/rA:10cCCCOO+OCOO+O/rB:s1;s2;d3;s3;s2;s1;d7;s7;s1;/rC:;;;;;;;;;;

Chemical Details

Atom Count
Formula:C4H8O6+2
All Atoms:10
Heavy Atoms:10
Chiral Atoms:2
ZAP Information [?]
Total:-120.589
Area:291.025
Solvation:-127.865
Coulombic:-54.3354
Bond Count [?]
All:9
Single:7
Double:2
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:152.103
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:-2.24
LogP (Chemaxon):-1.23

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Descriptor Annotations

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