chloro(fluorooxy)phosphinic acid;chlorophosphonic acid

H9Cl5FO15P5 — CID 175540690

IUPACchloro(fluorooxy)phosphinic acid;chlorophosphonic acid
SMILESO=P(O)(Cl)OF.O=P(O)(O)Cl.O=P(O)(O)Cl.O=P(O)(O)Cl.O=P(O)(O)Cl
InChIInChI=1S/ClFHO3P.4ClH2O3P/c1-6(3,4)5-2;4*1-5(2,3)4/h(H,3,4);4*(H2,2,3,4)
InChIKeyNFSNKLVRYLPHNY-UHFFFAOYSA-N
MW600.19 g/mol
LogP2.50
Rot. Bonds1

About chloro(fluorooxy)phosphinic acid;chlorophosphonic acid

chloro(fluorooxy)phosphinic acid;chlorophosphonic acid (PubChem CID 175540690) has the molecular formula H9Cl5FO15P5 and a molecular weight of 600.19 g/mol. Its IUPAC name is chloro(fluorooxy)phosphinic acid;chlorophosphonic acid.

Molecular Properties

Compound Namechloro(fluorooxy)phosphinic acid;chlorophosphonic acid
PubChem CID175540690
Molecular FormulaH9Cl5FO15P5
Molecular Weight600.19 g/mol
Exact Mass597.71
IUPAC Namechloro(fluorooxy)phosphinic acid;chlorophosphonic acid
SMILESO=P(O)(Cl)OF.O=P(O)(O)Cl.O=P(O)(O)Cl.O=P(O)(O)Cl.O=P(O)(O)Cl
InChIInChI=1S/ClFHO3P.4ClH2O3P/c1-6(3,4)5-2;4*1-5(2,3)4/h(H,3,4);4*(H2,2,3,4)
InChIKeyNFSNKLVRYLPHNY-UHFFFAOYSA-N
XLogP2.50
TPSA276.65 Ų
H-Bond Donors9
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500600.19
LogP ≤ 52.50
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

fluoro dihydrogen phosphate;iron
CID 173042796
fluoro dihydrogen phosphate;platinum
CID 174846501
calcium;fluoro dihydrogen phosphate;hydride
CID 174626748
ethene;fluoro dihydrogen phosphate
CID 87187087
azane;fluoro dihydrogen phosphate;1,2,3,4,5,6-hexachlorocyclohexane
CID 87442574
sodium;fluoro dihydrogen phosphate;hydride;iron
CID 173004802
calcium;magnesium;fluoro dihydrogen phosphate;hydride
CID 174988719
chlorophosphonic acid;lanthanum
CID 173408477
chloro(chlorooxy)phosphinic acid;phosphoric acid
CID 158658993
beryllium fluoro phosphate
CID 175504741
chloro(fluoro)phosphinic acid;manganese;stibane
CID 173364992
bromo fluoro hydrogen phosphate
CID 174047934

Frequently Asked Questions

What is the IUPAC name of chloro(fluorooxy)phosphinic acid;chlorophosphonic acid?
The IUPAC name of chloro(fluorooxy)phosphinic acid;chlorophosphonic acid (CID 175540690) is chloro(fluorooxy)phosphinic acid;chlorophosphonic acid.
What is the SMILES notation for chloro(fluorooxy)phosphinic acid;chlorophosphonic acid?
The canonical SMILES for chloro(fluorooxy)phosphinic acid;chlorophosphonic acid is O=P(O)(Cl)OF.O=P(O)(O)Cl.O=P(O)(O)Cl.O=P(O)(O)Cl.O=P(O)(O)Cl.
What is the InChIKey of chloro(fluorooxy)phosphinic acid;chlorophosphonic acid?
The InChIKey is NFSNKLVRYLPHNY-UHFFFAOYSA-N. The full InChI is InChI=1S/ClFHO3P.4ClH2O3P/c1-6(3,4)5-2;4*1-5(2,3)4/h(H,3,4);4*(H2,2,3,4).
What are the key properties of chloro(fluorooxy)phosphinic acid;chlorophosphonic acid?
chloro(fluorooxy)phosphinic acid;chlorophosphonic acid has a molecular weight of 600.19 g/mol, XLogP of 2.50, 1 rotatable bonds, 9 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(fluorooxy)phosphinic acid;chlorophosphonic acid is sourced from PubChem (CID 175540690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).