barium(2+);ethyl(propyl)phosphinic acid;hydride

C5H15BaO2P — CID 174823068

IUPACbarium(2+);ethyl(propyl)phosphinic acid;hydride
SMILESCCCP(=O)(O)CC.[Ba+2].[H-].[H-]
InChIInChI=1S/C5H13O2P.Ba.2H/c1-3-5-8(6,7)4-2;;;/h3-5H2,1-2H3,(H,6,7);;;/q;+2;2*-1
InChIKeyWCGZQQDVSFIPEM-UHFFFAOYSA-N
MW275.47 g/mol
LogP1.53
Rot. Bonds3

About barium(2+);ethyl(propyl)phosphinic acid;hydride

barium(2+);ethyl(propyl)phosphinic acid;hydride (PubChem CID 174823068) has the molecular formula C5H15BaO2P and a molecular weight of 275.47 g/mol. Its IUPAC name is barium(2+);ethyl(propyl)phosphinic acid;hydride.

Molecular Properties

Compound Namebarium(2+);ethyl(propyl)phosphinic acid;hydride
PubChem CID174823068
Molecular FormulaC5H15BaO2P
Molecular Weight275.47 g/mol
Exact Mass275.99
IUPAC Namebarium(2+);ethyl(propyl)phosphinic acid;hydride
SMILESCCCP(=O)(O)CC.[Ba+2].[H-].[H-]
InChIInChI=1S/C5H13O2P.Ba.2H/c1-3-5-8(6,7)4-2;;;/h3-5H2,1-2H3,(H,6,7);;;/q;+2;2*-1
InChIKeyWCGZQQDVSFIPEM-UHFFFAOYSA-N
XLogP1.53
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.47
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

magnesium;dipropylphosphinic acid;hydride
CID 175497166
diethylphosphinic acid
CID 123698390
bis(diethylphosphinic acid);zinc
CID 91997271
alumane;butyl(propyl)phosphinic acid
CID 174987333
dihexylphosphinic acid;hexyl(propyl)phosphinic acid
CID 122574606
3-[ethyl(hydroxy)phosphoryl]propanoic acid
CID 19011064
methyl(propyl)phosphinic acid
CID 10992780
ethyl(2-oxopentyl)phosphinic acid
CID 118026065
tris(dipropylphosphinic acid);propane-1,2,3-triol
CID 173171073
sodium;ethylphosphonic acid;hydride
CID 173023675
dipropylphosphorylmethanol
CID 18981637
propylphosphonamidic acid
CID 22250964

Frequently Asked Questions

What is the IUPAC name of barium(2+);ethyl(propyl)phosphinic acid;hydride?
The IUPAC name of barium(2+);ethyl(propyl)phosphinic acid;hydride (CID 174823068) is barium(2+);ethyl(propyl)phosphinic acid;hydride.
What is the SMILES notation for barium(2+);ethyl(propyl)phosphinic acid;hydride?
The canonical SMILES for barium(2+);ethyl(propyl)phosphinic acid;hydride is CCCP(=O)(O)CC.[Ba+2].[H-].[H-].
What is the InChIKey of barium(2+);ethyl(propyl)phosphinic acid;hydride?
The InChIKey is WCGZQQDVSFIPEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13O2P.Ba.2H/c1-3-5-8(6,7)4-2;;;/h3-5H2,1-2H3,(H,6,7);;;/q;+2;2*-1.
What are the key properties of barium(2+);ethyl(propyl)phosphinic acid;hydride?
barium(2+);ethyl(propyl)phosphinic acid;hydride has a molecular weight of 275.47 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for barium(2+);ethyl(propyl)phosphinic acid;hydride is sourced from PubChem (CID 174823068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).