CID 129137181

C3H6Na2O3 — CID 129137181

IUPAC—
SMILESCC(O)C(=O)O.[Na].[Na]
InChIInChI=1S/C3H6O3.2Na/c1-2(4)3(5)6;;/h2,4H,1H3,(H,5,6);;
InChIKeyFGWRFNZJJIOZFD-UHFFFAOYSA-N
MW136.06 g/mol
LogP-1.31
Rot. Bonds1

About CID 129137181

CID 129137181 (PubChem CID 129137181) has the molecular formula C3H6Na2O3 and a molecular weight of 136.06 g/mol.

Molecular Properties

Compound NameCID 129137181
PubChem CID129137181
Molecular FormulaC3H6Na2O3
Molecular Weight136.06 g/mol
Exact Mass136.01
IUPAC Name—
SMILESCC(O)C(=O)O.[Na].[Na]
InChIInChI=1S/C3H6O3.2Na/c1-2(4)3(5)6;;/h2,4H,1H3,(H,5,6);;
InChIKeyFGWRFNZJJIOZFD-UHFFFAOYSA-N
XLogP-1.31
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.06
LogP ≤ 5-1.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 129137181?
The IUPAC name of CID 129137181 (CID 129137181) is not available.
What is the SMILES notation for CID 129137181?
The canonical SMILES for CID 129137181 is CC(O)C(=O)O.[Na].[Na].
What is the InChIKey of CID 129137181?
The InChIKey is FGWRFNZJJIOZFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O3.2Na/c1-2(4)3(5)6;;/h2,4H,1H3,(H,5,6);;.
What are the key properties of CID 129137181?
CID 129137181 has a molecular weight of 136.06 g/mol, XLogP of -1.31, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 129137181 is sourced from PubChem (CID 129137181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).