2-difluorophosphoryloxypropane

C3H7F2O2P — CID 23443857

IUPAC2-difluorophosphoryloxypropane
SMILESCC(C)OP(=O)(F)F
InChIInChI=1S/C3H7F2O2P/c1-3(2)7-8(4,5)6/h3H,1-2H3
InChIKeySUFMIVOJHHRBOU-UHFFFAOYSA-N
MW144.06 g/mol
LogP2.46
Rot. Bonds2

About 2-difluorophosphoryloxypropane

2-difluorophosphoryloxypropane (PubChem CID 23443857) has the molecular formula C3H7F2O2P and a molecular weight of 144.06 g/mol. Its IUPAC name is 2-difluorophosphoryloxypropane.

Molecular Properties

Compound Name2-difluorophosphoryloxypropane
PubChem CID23443857
Molecular FormulaC3H7F2O2P
Molecular Weight144.06 g/mol
Exact Mass144.02
IUPAC Name2-difluorophosphoryloxypropane
SMILESCC(C)OP(=O)(F)F
InChIInChI=1S/C3H7F2O2P/c1-3(2)7-8(4,5)6/h3H,1-2H3
InChIKeySUFMIVOJHHRBOU-UHFFFAOYSA-N
XLogP2.46
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.06
LogP ≤ 52.46
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 2-difluorophosphoryloxypropane?
The IUPAC name of 2-difluorophosphoryloxypropane (CID 23443857) is 2-difluorophosphoryloxypropane.
What is the SMILES notation for 2-difluorophosphoryloxypropane?
The canonical SMILES for 2-difluorophosphoryloxypropane is CC(C)OP(=O)(F)F.
What is the InChIKey of 2-difluorophosphoryloxypropane?
The InChIKey is SUFMIVOJHHRBOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7F2O2P/c1-3(2)7-8(4,5)6/h3H,1-2H3.
What are the key properties of 2-difluorophosphoryloxypropane?
2-difluorophosphoryloxypropane has a molecular weight of 144.06 g/mol, XLogP of 2.46, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-difluorophosphoryloxypropane is sourced from PubChem (CID 23443857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).