CID 139243453

C3H4O3- — CID 139243453

IUPAC—
SMILES[CH2]C(O)C(=O)[O-]
InChIInChI=1S/C3H5O3/c1-2(4)3(5)6/h2,4H,1H2,(H,5,6)/p-1
InChIKeyOGZCUQXOOQQARZ-UHFFFAOYSA-M
MW88.06 g/mol
LogP-2.07
Rot. Bonds1

About CID 139243453

CID 139243453 (PubChem CID 139243453) has the molecular formula C3H4O3- and a molecular weight of 88.06 g/mol.

Molecular Properties

Compound NameCID 139243453
PubChem CID139243453
Molecular FormulaC3H4O3-
Molecular Weight88.06 g/mol
Exact Mass88.02
IUPAC Name—
SMILES[CH2]C(O)C(=O)[O-]
InChIInChI=1S/C3H5O3/c1-2(4)3(5)6/h2,4H,1H2,(H,5,6)/p-1
InChIKeyOGZCUQXOOQQARZ-UHFFFAOYSA-M
XLogP-2.07
TPSA60.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.06
LogP ≤ 5-2.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,3-dihydroxybutanedioate
CID 19608871
dipotassium;(2R,3S)-2,3-dihydroxybutanedioate
CID 6452017
dibismuth;tris((2R,3R)-2,3-dihydroxybutanedioate)
CID 3080629
2,3-dihydroxybutanedioate;manganese(2+)
CID 22027285
zinc 2-hydroxypropanedioate
CID 20549630
sodium 2-ethenylbut-3-enoate
CID 23676567
copper;2,3-dihydroxybutanedioate;tetrahydrate
CID 159915205
dibismuth;tris(2,3-dihydroxybutanedioate);hexahydrate
CID 173203823
aluminum tris((2R)-2-hydroxypropanoate)
CID 175713416
calcium;2,3-dihydroxybutanedioate;hydrate
CID 161409159
copper(1+);2,3-dihydroxybutanedioate;hydrate
CID 22034457
tris(2-hydroxypropanoate);zirconium(3+)
CID 3048680

Frequently Asked Questions

What is the IUPAC name of CID 139243453?
The IUPAC name of CID 139243453 (CID 139243453) is not available.
What is the SMILES notation for CID 139243453?
The canonical SMILES for CID 139243453 is [CH2]C(O)C(=O)[O-].
What is the InChIKey of CID 139243453?
The InChIKey is OGZCUQXOOQQARZ-UHFFFAOYSA-M. The full InChI is InChI=1S/C3H5O3/c1-2(4)3(5)6/h2,4H,1H2,(H,5,6)/p-1.
What are the key properties of CID 139243453?
CID 139243453 has a molecular weight of 88.06 g/mol, XLogP of -2.07, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 139243453 is sourced from PubChem (CID 139243453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).