phosphoric acid;trichlorophosphane

H3Cl3O4P2 — CID 161146022

IUPACphosphoric acid;trichlorophosphane
SMILESClP(Cl)Cl.O=P(O)(O)O
InChIInChI=1S/Cl3P.H3O4P/c1-4(2)3;1-5(2,3)4/h;(H3,1,2,3,4)
InChIKeyUOBCNBFNMYCNST-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.00
Rot. Bonds

About phosphoric acid;trichlorophosphane

phosphoric acid;trichlorophosphane (PubChem CID 161146022) has the molecular formula H3Cl3O4P2 and a molecular weight of 235.33 g/mol. Its IUPAC name is phosphoric acid;trichlorophosphane.

Molecular Properties

Compound Namephosphoric acid;trichlorophosphane
PubChem CID161146022
Molecular FormulaH3Cl3O4P2
Molecular Weight235.33 g/mol
Exact Mass233.86
IUPAC Namephosphoric acid;trichlorophosphane
SMILESClP(Cl)Cl.O=P(O)(O)O
InChIInChI=1S/Cl3P.H3O4P/c1-4(2)3;1-5(2,3)4/h;(H3,1,2,3,4)
InChIKeyUOBCNBFNMYCNST-UHFFFAOYSA-N
XLogP2.00
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

phosphoric acid;sulfuric acid;trichlorophosphane
CID 174477268
beryllium;hydride;phosphoric acid;hydrofluoride
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beryllium;hydride;niobium;phosphoric acid
CID 175325214
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tetralithium;phosphoric acid
CID 175822939
phosphoric acid;titanium
CID 173034953
phosphoric acid;octahydrate
CID 173160172
phosphane;phosphoric acid
CID 172840180
phosphoric acid;hydrate
CID 22023151
CID 159816390
CID 159816390
hydrogen peroxide;phosphoric acid
CID 18509931
iron;phosphoric acid
CID 174838016

Frequently Asked Questions

What is the IUPAC name of phosphoric acid;trichlorophosphane?
The IUPAC name of phosphoric acid;trichlorophosphane (CID 161146022) is phosphoric acid;trichlorophosphane.
What is the SMILES notation for phosphoric acid;trichlorophosphane?
The canonical SMILES for phosphoric acid;trichlorophosphane is ClP(Cl)Cl.O=P(O)(O)O.
What is the InChIKey of phosphoric acid;trichlorophosphane?
The InChIKey is UOBCNBFNMYCNST-UHFFFAOYSA-N. The full InChI is InChI=1S/Cl3P.H3O4P/c1-4(2)3;1-5(2,3)4/h;(H3,1,2,3,4).
What are the key properties of phosphoric acid;trichlorophosphane?
phosphoric acid;trichlorophosphane has a molecular weight of 235.33 g/mol, XLogP of 2.00, 0 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phosphoric acid;trichlorophosphane is sourced from PubChem (CID 161146022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).