ethyl(hydroperoxy)phosphinic acid;rhenium

C2H7O4PRe — CID 174770512

IUPACethyl(hydroperoxy)phosphinic acid;rhenium
SMILESCCP(=O)(O)OO.[Re]
InChIInChI=1S/C2H7O4P.Re/c1-2-7(4,5)6-3;/h3H,2H2,1H3,(H,4,5);
InChIKeyVRFIFBJWFCFREF-UHFFFAOYSA-N
MW312.26 g/mol
LogP0.68
Rot. Bonds2

About ethyl(hydroperoxy)phosphinic acid;rhenium

ethyl(hydroperoxy)phosphinic acid;rhenium (PubChem CID 174770512) has the molecular formula C2H7O4PRe and a molecular weight of 312.26 g/mol. Its IUPAC name is ethyl(hydroperoxy)phosphinic acid;rhenium.

Molecular Properties

Compound Nameethyl(hydroperoxy)phosphinic acid;rhenium
PubChem CID174770512
Molecular FormulaC2H7O4PRe
Molecular Weight312.26 g/mol
Exact Mass312.96
IUPAC Nameethyl(hydroperoxy)phosphinic acid;rhenium
SMILESCCP(=O)(O)OO.[Re]
InChIInChI=1S/C2H7O4P.Re/c1-2-7(4,5)6-3;/h3H,2H2,1H3,(H,4,5);
InChIKeyVRFIFBJWFCFREF-UHFFFAOYSA-N
XLogP0.68
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.26
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

ethyl(hydroperoxy)phosphinic acid
CID 54175112
ethyl-[(2-methylpropan-2-yl)oxy]phosphinic acid
CID 139581745
aminomethyl(hydroperoxy)phosphinic acid
CID 142766787
CID 87274277
CID 87274277
butoxy(ethyl)phosphinic acid
CID 71353007
diethylphosphinic acid
CID 123698390
ethylphosphonic acid;phosphoric acid
CID 87124135
ethylphosphonic acid;zirconium
CID 161117919
hexakis(decane);hydroxy dihydrogen phosphate
CID 173398841
ethyl(prop-2-enoyloxy)phosphinic acid
CID 174324939
2-chloroethylperoxy(ethyl)phosphinic acid
CID 174902353
bis(diethylphosphinic acid);zinc
CID 91997271

Frequently Asked Questions

What is the IUPAC name of ethyl(hydroperoxy)phosphinic acid;rhenium?
The IUPAC name of ethyl(hydroperoxy)phosphinic acid;rhenium (CID 174770512) is ethyl(hydroperoxy)phosphinic acid;rhenium.
What is the SMILES notation for ethyl(hydroperoxy)phosphinic acid;rhenium?
The canonical SMILES for ethyl(hydroperoxy)phosphinic acid;rhenium is CCP(=O)(O)OO.[Re].
What is the InChIKey of ethyl(hydroperoxy)phosphinic acid;rhenium?
The InChIKey is VRFIFBJWFCFREF-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7O4P.Re/c1-2-7(4,5)6-3;/h3H,2H2,1H3,(H,4,5);.
What are the key properties of ethyl(hydroperoxy)phosphinic acid;rhenium?
ethyl(hydroperoxy)phosphinic acid;rhenium has a molecular weight of 312.26 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl(hydroperoxy)phosphinic acid;rhenium is sourced from PubChem (CID 174770512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).