(2-fluorophenyl)methylphosphonic acid

C7H8FO3P — CID 14926086

IUPAC(2-fluorophenyl)methylphosphonic acid
SMILESO=P(O)(O)Cc1ccccc1F
InChIInChI=1S/C7H8FO3P/c8-7-4-2-1-3-6(7)5-12(9,10)11/h1-4H,5H2,(H2,9,10,11)
InChIKeyKNZXJOCOROFSOJ-UHFFFAOYSA-N
MW190.11 g/mol
LogP1.50
Rot. Bonds2

About (2-fluorophenyl)methylphosphonic acid

(2-fluorophenyl)methylphosphonic acid (PubChem CID 14926086) has the molecular formula C7H8FO3P and a molecular weight of 190.11 g/mol. Its IUPAC name is (2-fluorophenyl)methylphosphonic acid.

Molecular Properties

Compound Name(2-fluorophenyl)methylphosphonic acid
PubChem CID14926086
Molecular FormulaC7H8FO3P
Molecular Weight190.11 g/mol
Exact Mass190.02
IUPAC Name(2-fluorophenyl)methylphosphonic acid
SMILESO=P(O)(O)Cc1ccccc1F
InChIInChI=1S/C7H8FO3P/c8-7-4-2-1-3-6(7)5-12(9,10)11/h1-4H,5H2,(H2,9,10,11)
InChIKeyKNZXJOCOROFSOJ-UHFFFAOYSA-N
XLogP1.50
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.11
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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-fluorophenyl)methylphosphonic acid?
The IUPAC name of (2-fluorophenyl)methylphosphonic acid (CID 14926086) is (2-fluorophenyl)methylphosphonic acid.
What is the SMILES notation for (2-fluorophenyl)methylphosphonic acid?
The canonical SMILES for (2-fluorophenyl)methylphosphonic acid is O=P(O)(O)Cc1ccccc1F.
What is the InChIKey of (2-fluorophenyl)methylphosphonic acid?
The InChIKey is KNZXJOCOROFSOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8FO3P/c8-7-4-2-1-3-6(7)5-12(9,10)11/h1-4H,5H2,(H2,9,10,11).
What are the key properties of (2-fluorophenyl)methylphosphonic acid?
(2-fluorophenyl)methylphosphonic acid has a molecular weight of 190.11 g/mol, XLogP of 1.50, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)methylphosphonic acid is sourced from PubChem (CID 14926086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).