sodium methoxymethanolate

C2H5NaO2 — CID 23708081

IUPACsodium methoxymethanolate
SMILESCOC[O-].[Na+]
InChIInChI=1S/C2H5O2.Na/c1-4-2-3;/h2H2,1H3;/q-1;+1
InChIKeyTTZBIGVCLJLWOM-UHFFFAOYSA-N
MW84.05 g/mol
LogP-4.05
Rot. Bonds1

About sodium methoxymethanolate

sodium methoxymethanolate (PubChem CID 23708081) has the molecular formula C2H5NaO2 and a molecular weight of 84.05 g/mol. Its IUPAC name is sodium methoxymethanolate.

Molecular Properties

Compound Namesodium methoxymethanolate
PubChem CID23708081
Molecular FormulaC2H5NaO2
Molecular Weight84.05 g/mol
Exact Mass84.02
IUPAC Namesodium methoxymethanolate
SMILESCOC[O-].[Na+]
InChIInChI=1S/C2H5O2.Na/c1-4-2-3;/h2H2,1H3;/q-1;+1
InChIKeyTTZBIGVCLJLWOM-UHFFFAOYSA-N
XLogP-4.05
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50084.05
LogP ≤ 5-4.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

gallium tris(2-methoxyethanolate)
CID 101193037
barium(2+);bis(2-methoxyethanolate)
CID 14619879
lead(2+);bis(2-methoxyethanolate)
CID 86746666
dysprosium(3+);tris(2-methoxyethanolate)
CID 18415177
disodium;1,2-dimethoxyethane;carbonate
CID 86669059
2-methoxyethanolate;niobium(5+);tetrachloride
CID 102395600
sodium;methanolate;2-methoxyethanol
CID 88740806
methoxymethyltin(3+)
CID 19968639
sodium 2-methoxy-2-oxoethanolate
CID 23673095
methoxy(oxidooxy)methane
CID 102170824
4-methoxybut-2-en-2-olate
CID 58028382
1-methoxybutan-2-olate
CID 148972331

Frequently Asked Questions

What is the IUPAC name of sodium methoxymethanolate?
The IUPAC name of sodium methoxymethanolate (CID 23708081) is sodium methoxymethanolate.
What is the SMILES notation for sodium methoxymethanolate?
The canonical SMILES for sodium methoxymethanolate is COC[O-].[Na+].
What is the InChIKey of sodium methoxymethanolate?
The InChIKey is TTZBIGVCLJLWOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5O2.Na/c1-4-2-3;/h2H2,1H3;/q-1;+1.
What are the key properties of sodium methoxymethanolate?
sodium methoxymethanolate has a molecular weight of 84.05 g/mol, XLogP of -4.05, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium methoxymethanolate is sourced from PubChem (CID 23708081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).