1,3,2-dioxaphospholane

C2H5O2P — CID 15559062

IUPAC1,3,2-dioxaphospholane
SMILESC1COPO1
InChIInChI=1S/C2H5O2P/c1-2-4-5-3-1/h5H,1-2H2
InChIKeyFZRJLBJACDITKM-UHFFFAOYSA-N
MW92.03 g/mol
LogP0.54
Rot. Bonds

About 1,3,2-dioxaphospholane

1,3,2-dioxaphospholane (PubChem CID 15559062) has the molecular formula C2H5O2P and a molecular weight of 92.03 g/mol. Its IUPAC name is 1,3,2-dioxaphospholane.

Molecular Properties

Compound Name1,3,2-dioxaphospholane
PubChem CID15559062
Molecular FormulaC2H5O2P
Molecular Weight92.03 g/mol
Exact Mass92.00
IUPAC Name1,3,2-dioxaphospholane
SMILESC1COPO1
InChIInChI=1S/C2H5O2P/c1-2-4-5-3-1/h5H,1-2H2
InChIKeyFZRJLBJACDITKM-UHFFFAOYSA-N
XLogP0.54
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.03
LogP ≤ 50.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,3,2-dioxaphospholane?
The IUPAC name of 1,3,2-dioxaphospholane (CID 15559062) is 1,3,2-dioxaphospholane.
What is the SMILES notation for 1,3,2-dioxaphospholane?
The canonical SMILES for 1,3,2-dioxaphospholane is C1COPO1.
What is the InChIKey of 1,3,2-dioxaphospholane?
The InChIKey is FZRJLBJACDITKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5O2P/c1-2-4-5-3-1/h5H,1-2H2.
What are the key properties of 1,3,2-dioxaphospholane?
1,3,2-dioxaphospholane has a molecular weight of 92.03 g/mol, XLogP of 0.54, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,2-dioxaphospholane is sourced from PubChem (CID 15559062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).