trisodium;acetic acid;hydride

C6H15Na3O6 — CID 172996834

IUPACtrisodium;acetic acid;hydride
SMILESCC(=O)O.CC(=O)O.CC(=O)O.[H-].[H-].[H-].[Na+].[Na+].[Na+]
InChIInChI=1S/3C2H4O2.3Na.3H/c3*1-2(3)4;;;;;;/h3*1H3,(H,3,4);;;;;;/q;;;3*+1;3*-1
InChIKeyMBDGKPQWNKKLJG-UHFFFAOYSA-N
MW252.15 g/mol
LogP-8.38
Rot. Bonds

About trisodium;acetic acid;hydride

trisodium;acetic acid;hydride (PubChem CID 172996834) has the molecular formula C6H15Na3O6 and a molecular weight of 252.15 g/mol. Its IUPAC name is trisodium;acetic acid;hydride.

Molecular Properties

Compound Nametrisodium;acetic acid;hydride
PubChem CID172996834
Molecular FormulaC6H15Na3O6
Molecular Weight252.15 g/mol
Exact Mass252.06
IUPAC Nametrisodium;acetic acid;hydride
SMILESCC(=O)O.CC(=O)O.CC(=O)O.[H-].[H-].[H-].[Na+].[Na+].[Na+]
InChIInChI=1S/3C2H4O2.3Na.3H/c3*1-2(3)4;;;;;;/h3*1H3,(H,3,4);;;;;;/q;;;3*+1;3*-1
InChIKeyMBDGKPQWNKKLJG-UHFFFAOYSA-N
XLogP-8.38
TPSA111.90 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.15
LogP ≤ 5-8.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

tricosasodium;acetic acid;hydride
CID 173423110
sodium;acetic acid;hydride;silane
CID 173357169
sodium;acetic acid;hydride;iridium
CID 175527395
sodium;acetic acid;hydride;rubidium(1+)
CID 173203449
hexasodium;acetic acid;azane;hydride
CID 173374702
calcium;sodium;acetic acid;hydride
CID 173169093
magnesium;sodium;acetic acid;hydride;trihydrate
CID 173259653
sodium;acetic acid;alumane;hydride;hydrochloride
CID 173360120
sodium;acetic acid;cobalt;hydride;manganese
CID 175418029
sodium;acetic acid;carbonic acid;hydride;zinc
CID 174483290
magnesium;acetic acid;hydride
CID 172995175
henicosamagnesium;acetic acid;hydride
CID 173442224

Frequently Asked Questions

What is the IUPAC name of trisodium;acetic acid;hydride?
The IUPAC name of trisodium;acetic acid;hydride (CID 172996834) is trisodium;acetic acid;hydride.
What is the SMILES notation for trisodium;acetic acid;hydride?
The canonical SMILES for trisodium;acetic acid;hydride is CC(=O)O.CC(=O)O.CC(=O)O.[H-].[H-].[H-].[Na+].[Na+].[Na+].
What is the InChIKey of trisodium;acetic acid;hydride?
The InChIKey is MBDGKPQWNKKLJG-UHFFFAOYSA-N. The full InChI is InChI=1S/3C2H4O2.3Na.3H/c3*1-2(3)4;;;;;;/h3*1H3,(H,3,4);;;;;;/q;;;3*+1;3*-1.
What are the key properties of trisodium;acetic acid;hydride?
trisodium;acetic acid;hydride has a molecular weight of 252.15 g/mol, XLogP of -8.38, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for trisodium;acetic acid;hydride is sourced from PubChem (CID 172996834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).