ethanol;phosphinous acid;hydrochloride

C4H16ClO3P — CID 153367086

IUPACethanol;phosphinous acid;hydrochloride
SMILESCCO.CCO.Cl.OP
InChIInChI=1S/2C2H6O.ClH.H3OP/c2*1-2-3;;1-2/h2*3H,2H2,1H3;1H;1H,2H2
InChIKeyORCFKLVFZKAJQQ-UHFFFAOYSA-N
MW178.60 g/mol
LogP0.19
Rot. Bonds

About ethanol;phosphinous acid;hydrochloride

ethanol;phosphinous acid;hydrochloride (PubChem CID 153367086) has the molecular formula C4H16ClO3P and a molecular weight of 178.60 g/mol. Its IUPAC name is ethanol;phosphinous acid;hydrochloride.

Molecular Properties

Compound Nameethanol;phosphinous acid;hydrochloride
PubChem CID153367086
Molecular FormulaC4H16ClO3P
Molecular Weight178.60 g/mol
Exact Mass178.05
IUPAC Nameethanol;phosphinous acid;hydrochloride
SMILESCCO.CCO.Cl.OP
InChIInChI=1S/2C2H6O.ClH.H3OP/c2*1-2-3;;1-2/h2*3H,2H2,1H3;1H;1H,2H2
InChIKeyORCFKLVFZKAJQQ-UHFFFAOYSA-N
XLogP0.19
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.60
LogP ≤ 50.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of ethanol;phosphinous acid;hydrochloride?
The IUPAC name of ethanol;phosphinous acid;hydrochloride (CID 153367086) is ethanol;phosphinous acid;hydrochloride.
What is the SMILES notation for ethanol;phosphinous acid;hydrochloride?
The canonical SMILES for ethanol;phosphinous acid;hydrochloride is CCO.CCO.Cl.OP.
What is the InChIKey of ethanol;phosphinous acid;hydrochloride?
The InChIKey is ORCFKLVFZKAJQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H6O.ClH.H3OP/c2*1-2-3;;1-2/h2*3H,2H2,1H3;1H;1H,2H2.
What are the key properties of ethanol;phosphinous acid;hydrochloride?
ethanol;phosphinous acid;hydrochloride has a molecular weight of 178.60 g/mol, XLogP of 0.19, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;phosphinous acid;hydrochloride is sourced from PubChem (CID 153367086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).