chloro(chlorooxy)phosphinic acid;phosphoric acid

H4Cl2O7P2 — CID 158658993

IUPACchloro(chlorooxy)phosphinic acid;phosphoric acid
SMILESO=P(O)(Cl)OCl.O=P(O)(O)O
InChIInChI=1S/Cl2HO3P.H3O4P/c1-5-6(2,3)4;1-5(2,3)4/h(H,3,4);(H3,1,2,3,4)
InChIKeyDWNDMTOTXXMNBS-UHFFFAOYSA-N
MW248.88 g/mol
LogP0.57
Rot. Bonds1

About chloro(chlorooxy)phosphinic acid;phosphoric acid

chloro(chlorooxy)phosphinic acid;phosphoric acid (PubChem CID 158658993) has the molecular formula H4Cl2O7P2 and a molecular weight of 248.88 g/mol. Its IUPAC name is chloro(chlorooxy)phosphinic acid;phosphoric acid.

Molecular Properties

Compound Namechloro(chlorooxy)phosphinic acid;phosphoric acid
PubChem CID158658993
Molecular FormulaH4Cl2O7P2
Molecular Weight248.88 g/mol
Exact Mass247.88
IUPAC Namechloro(chlorooxy)phosphinic acid;phosphoric acid
SMILESO=P(O)(Cl)OCl.O=P(O)(O)O
InChIInChI=1S/Cl2HO3P.H3O4P/c1-5-6(2,3)4;1-5(2,3)4/h(H,3,4);(H3,1,2,3,4)
InChIKeyDWNDMTOTXXMNBS-UHFFFAOYSA-N
XLogP0.57
TPSA124.29 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.88
LogP ≤ 50.57
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl hypochlorite;phosphoric acid
CID 175163315
chloro(fluorooxy)phosphinic acid;chlorophosphonic acid
CID 175540690
beryllium;hydride;niobium;phosphoric acid
CID 175325214
chlorophosphonic acid;lanthanum
CID 173408477
beryllium;hydride;phosphoric acid;hydrofluoride
CID 173435189
phosphoric acid;octahydrate
CID 173160172
phosphoric acid;titanium
CID 173034953
CID 173050648
CID 173050648
cerium;phosphoric acid
CID 90659592
iron;phosphoric acid
CID 174838016
methane;phosphoric acid
CID 173400304
methane;phosphoric acid
CID 18515646

Frequently Asked Questions

What is the IUPAC name of chloro(chlorooxy)phosphinic acid;phosphoric acid?
The IUPAC name of chloro(chlorooxy)phosphinic acid;phosphoric acid (CID 158658993) is chloro(chlorooxy)phosphinic acid;phosphoric acid.
What is the SMILES notation for chloro(chlorooxy)phosphinic acid;phosphoric acid?
The canonical SMILES for chloro(chlorooxy)phosphinic acid;phosphoric acid is O=P(O)(Cl)OCl.O=P(O)(O)O.
What is the InChIKey of chloro(chlorooxy)phosphinic acid;phosphoric acid?
The InChIKey is DWNDMTOTXXMNBS-UHFFFAOYSA-N. The full InChI is InChI=1S/Cl2HO3P.H3O4P/c1-5-6(2,3)4;1-5(2,3)4/h(H,3,4);(H3,1,2,3,4).
What are the key properties of chloro(chlorooxy)phosphinic acid;phosphoric acid?
chloro(chlorooxy)phosphinic acid;phosphoric acid has a molecular weight of 248.88 g/mol, XLogP of 0.57, 1 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(chlorooxy)phosphinic acid;phosphoric acid is sourced from PubChem (CID 158658993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).