zinc;butane;ethane;phosphenous acid

C6H15O2PZn — CID 174595531

IUPACzinc;butane;ethane;phosphenous acid
SMILESO=PO.[CH2-]C.[CH2-]CCC.[Zn+2]
InChIInChI=1S/C4H9.C2H5.HO2P.Zn/c1-3-4-2;1-2;1-3-2;/h1,3-4H2,2H3;1H2,2H3;(H,1,2);/q2*-1;;+2
InChIKeyUEXHXNJQPZOUFX-UHFFFAOYSA-N
MW215.55 g/mol
LogP2.64
Rot. Bonds1

About zinc;butane;ethane;phosphenous acid

zinc;butane;ethane;phosphenous acid (PubChem CID 174595531) has the molecular formula C6H15O2PZn and a molecular weight of 215.55 g/mol. Its IUPAC name is zinc;butane;ethane;phosphenous acid.

Molecular Properties

Compound Namezinc;butane;ethane;phosphenous acid
PubChem CID174595531
Molecular FormulaC6H15O2PZn
Molecular Weight215.55 g/mol
Exact Mass214.01
IUPAC Namezinc;butane;ethane;phosphenous acid
SMILESO=PO.[CH2-]C.[CH2-]CCC.[Zn+2]
InChIInChI=1S/C4H9.C2H5.HO2P.Zn/c1-3-4-2;1-2;1-3-2;/h1,3-4H2,2H3;1H2,2H3;(H,1,2);/q2*-1;;+2
InChIKeyUEXHXNJQPZOUFX-UHFFFAOYSA-N
XLogP2.64
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.55
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 174826071
azane;butane;phosphenous acid
CID 173067034
butane;ethane;titanium(2+)
CID 154083235
phosphenous acid;propane
CID 19090860
zinc;butane;oxygen(2-)
CID 158389994
zinc;butane;hydrobromide
CID 172807669
hexane;phosphenous acid
CID 21406649
butane;chlorotitanium(3+)
CID 24940344
butane;ethane;bis(titanium(3+));hydrate
CID 88509097
butane;lithium(1-)
CID 154172744
butane;tris(rubidium(1+))
CID 59203345
butane;nickel
CID 57419181

Frequently Asked Questions

What is the IUPAC name of zinc;butane;ethane;phosphenous acid?
The IUPAC name of zinc;butane;ethane;phosphenous acid (CID 174595531) is zinc;butane;ethane;phosphenous acid.
What is the SMILES notation for zinc;butane;ethane;phosphenous acid?
The canonical SMILES for zinc;butane;ethane;phosphenous acid is O=PO.[CH2-]C.[CH2-]CCC.[Zn+2].
What is the InChIKey of zinc;butane;ethane;phosphenous acid?
The InChIKey is UEXHXNJQPZOUFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9.C2H5.HO2P.Zn/c1-3-4-2;1-2;1-3-2;/h1,3-4H2,2H3;1H2,2H3;(H,1,2);/q2*-1;;+2.
What are the key properties of zinc;butane;ethane;phosphenous acid?
zinc;butane;ethane;phosphenous acid has a molecular weight of 215.55 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;butane;ethane;phosphenous acid is sourced from PubChem (CID 174595531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).