phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate

C5H7O4P — CID 58349989

IUPACphosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate
SMILESO=C(OP)C1=C(O)COC1
InChIInChI=1S/C5H7O4P/c6-4-2-8-1-3(4)5(7)9-10/h6H,1-2,10H2
InChIKeySCKKPIXZXDDJKO-UHFFFAOYSA-N
MW162.08 g/mol
LogP0.16
Rot. Bonds1

About phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate

phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate (PubChem CID 58349989) has the molecular formula C5H7O4P and a molecular weight of 162.08 g/mol. Its IUPAC name is phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate.

Molecular Properties

Compound Namephosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate
PubChem CID58349989
Molecular FormulaC5H7O4P
Molecular Weight162.08 g/mol
Exact Mass162.01
IUPAC Namephosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate
SMILESO=C(OP)C1=C(O)COC1
InChIInChI=1S/C5H7O4P/c6-4-2-8-1-3(4)5(7)9-10/h6H,1-2,10H2
InChIKeySCKKPIXZXDDJKO-UHFFFAOYSA-N
XLogP0.16
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.08
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate?
The IUPAC name of phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate (CID 58349989) is phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate.
What is the SMILES notation for phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate?
The canonical SMILES for phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate is O=C(OP)C1=C(O)COC1.
What is the InChIKey of phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate?
The InChIKey is SCKKPIXZXDDJKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7O4P/c6-4-2-8-1-3(4)5(7)9-10/h6H,1-2,10H2.
What are the key properties of phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate?
phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate has a molecular weight of 162.08 g/mol, XLogP of 0.16, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for phosphanyl 4-hydroxy-2,5-dihydrofuran-3-carboxylate is sourced from PubChem (CID 58349989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).