2-fluoroethoxy-methyl-oxophosphanium

C3H7FO2P+ — CID 13254736

IUPAC2-fluoroethoxy-methyl-oxophosphanium
SMILESC[P+](=O)OCCF
InChIInChI=1S/C3H7FO2P/c1-7(5)6-3-2-4/h2-3H2,1H3/q+1
InChIKeyQWBRWPWVXUXIHO-UHFFFAOYSA-N
MW125.06 g/mol
LogP1.34
Rot. Bonds3

About 2-fluoroethoxy-methyl-oxophosphanium

2-fluoroethoxy-methyl-oxophosphanium (PubChem CID 13254736) has the molecular formula C3H7FO2P+ and a molecular weight of 125.06 g/mol. Its IUPAC name is 2-fluoroethoxy-methyl-oxophosphanium.

Molecular Properties

Compound Name2-fluoroethoxy-methyl-oxophosphanium
PubChem CID13254736
Molecular FormulaC3H7FO2P+
Molecular Weight125.06 g/mol
Exact Mass125.02
IUPAC Name2-fluoroethoxy-methyl-oxophosphanium
SMILESC[P+](=O)OCCF
InChIInChI=1S/C3H7FO2P/c1-7(5)6-3-2-4/h2-3H2,1H3/q+1
InChIKeyQWBRWPWVXUXIHO-UHFFFAOYSA-N
XLogP1.34
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.06
LogP ≤ 51.34
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-fluoroethoxy-methyl-oxophosphanium?
The IUPAC name of 2-fluoroethoxy-methyl-oxophosphanium (CID 13254736) is 2-fluoroethoxy-methyl-oxophosphanium.
What is the SMILES notation for 2-fluoroethoxy-methyl-oxophosphanium?
The canonical SMILES for 2-fluoroethoxy-methyl-oxophosphanium is C[P+](=O)OCCF.
What is the InChIKey of 2-fluoroethoxy-methyl-oxophosphanium?
The InChIKey is QWBRWPWVXUXIHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7FO2P/c1-7(5)6-3-2-4/h2-3H2,1H3/q+1.
What are the key properties of 2-fluoroethoxy-methyl-oxophosphanium?
2-fluoroethoxy-methyl-oxophosphanium has a molecular weight of 125.06 g/mol, XLogP of 1.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoroethoxy-methyl-oxophosphanium is sourced from PubChem (CID 13254736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).