(cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid

C7H11FNO4P — CID 130422617

IUPAC(cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid
SMILESO=C(NOP(=O)(O)F)C1=CCCCC1
InChIInChI=1S/C7H11FNO4P/c8-14(11,12)13-9-7(10)6-4-2-1-3-5-6/h4H,1-3,5H2,(H,9,10)(H,11,12)
InChIKeyHKWFNGZWSKCWQN-UHFFFAOYSA-N
MW223.14 g/mol
LogP1.60
Rot. Bonds3

About (cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid

(cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid (PubChem CID 130422617) has the molecular formula C7H11FNO4P and a molecular weight of 223.14 g/mol. Its IUPAC name is (cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid.

Molecular Properties

Compound Name(cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid
PubChem CID130422617
Molecular FormulaC7H11FNO4P
Molecular Weight223.14 g/mol
Exact Mass223.04
IUPAC Name(cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid
SMILESO=C(NOP(=O)(O)F)C1=CCCCC1
InChIInChI=1S/C7H11FNO4P/c8-14(11,12)13-9-7(10)6-4-2-1-3-5-6/h4H,1-3,5H2,(H,9,10)(H,11,12)
InChIKeyHKWFNGZWSKCWQN-UHFFFAOYSA-N
XLogP1.60
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.14
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid?
The IUPAC name of (cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid (CID 130422617) is (cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid.
What is the SMILES notation for (cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid?
The canonical SMILES for (cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid is O=C(NOP(=O)(O)F)C1=CCCCC1.
What is the InChIKey of (cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid?
The InChIKey is HKWFNGZWSKCWQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11FNO4P/c8-14(11,12)13-9-7(10)6-4-2-1-3-5-6/h4H,1-3,5H2,(H,9,10)(H,11,12).
What are the key properties of (cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid?
(cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid has a molecular weight of 223.14 g/mol, XLogP of 1.60, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (cyclohexene-1-carbonylamino)oxy-fluorophosphinic acid is sourced from PubChem (CID 130422617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).