sodium;alumane;hydride;2-hydroxyacetyl chloride

C2H7AlClNaO2 — CID 175445587

IUPACsodium;alumane;hydride;2-hydroxyacetyl chloride
SMILESO=C(Cl)CO.[AlH3].[H-].[Na+]
InChIInChI=1S/C2H3ClO2.Al.Na.4H/c3-2(5)1-4;;;;;;/h4H,1H2;;;;;;/q;;+1;;;;-1
InChIKeyXVHOVALGFYRCDI-UHFFFAOYSA-N
MW148.50 g/mol
LogP-4.32
Rot. Bonds1

About sodium;alumane;hydride;2-hydroxyacetyl chloride

sodium;alumane;hydride;2-hydroxyacetyl chloride (PubChem CID 175445587) has the molecular formula C2H7AlClNaO2 and a molecular weight of 148.50 g/mol. Its IUPAC name is sodium;alumane;hydride;2-hydroxyacetyl chloride.

Molecular Properties

Compound Namesodium;alumane;hydride;2-hydroxyacetyl chloride
PubChem CID175445587
Molecular FormulaC2H7AlClNaO2
Molecular Weight148.50 g/mol
Exact Mass147.98
IUPAC Namesodium;alumane;hydride;2-hydroxyacetyl chloride
SMILESO=C(Cl)CO.[AlH3].[H-].[Na+]
InChIInChI=1S/C2H3ClO2.Al.Na.4H/c3-2(5)1-4;;;;;;/h4H,1H2;;;;;;/q;;+1;;;;-1
InChIKeyXVHOVALGFYRCDI-UHFFFAOYSA-N
XLogP-4.32
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.50
LogP ≤ 5-4.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acid_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of sodium;alumane;hydride;2-hydroxyacetyl chloride?
The IUPAC name of sodium;alumane;hydride;2-hydroxyacetyl chloride (CID 175445587) is sodium;alumane;hydride;2-hydroxyacetyl chloride.
What is the SMILES notation for sodium;alumane;hydride;2-hydroxyacetyl chloride?
The canonical SMILES for sodium;alumane;hydride;2-hydroxyacetyl chloride is O=C(Cl)CO.[AlH3].[H-].[Na+].
What is the InChIKey of sodium;alumane;hydride;2-hydroxyacetyl chloride?
The InChIKey is XVHOVALGFYRCDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3ClO2.Al.Na.4H/c3-2(5)1-4;;;;;;/h4H,1H2;;;;;;/q;;+1;;;;-1.
What are the key properties of sodium;alumane;hydride;2-hydroxyacetyl chloride?
sodium;alumane;hydride;2-hydroxyacetyl chloride has a molecular weight of 148.50 g/mol, XLogP of -4.32, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;alumane;hydride;2-hydroxyacetyl chloride is sourced from PubChem (CID 175445587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).