lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride

C4H9LiO5P+ — CID 175403249

IUPAClithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride
SMILESCCO[P+](=O)OC(=O)OC.[H-].[Li+]
InChIInChI=1S/C4H8O5P.Li.H/c1-3-8-10(6)9-4(5)7-2;;/h3H2,1-2H3;;/q2*+1;-1
InChIKeyCZKZJXQQLJYIEA-UHFFFAOYSA-N
MW175.03 g/mol
LogP-1.42
Rot. Bonds3

About lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride

lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride (PubChem CID 175403249) has the molecular formula C4H9LiO5P+ and a molecular weight of 175.03 g/mol. Its IUPAC name is lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride.

Molecular Properties

Compound Namelithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride
PubChem CID175403249
Molecular FormulaC4H9LiO5P+
Molecular Weight175.03 g/mol
Exact Mass175.03
IUPAC Namelithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride
SMILESCCO[P+](=O)OC(=O)OC.[H-].[Li+]
InChIInChI=1S/C4H8O5P.Li.H/c1-3-8-10(6)9-4(5)7-2;;/h3H2,1-2H3;;/q2*+1;-1
InChIKeyCZKZJXQQLJYIEA-UHFFFAOYSA-N
XLogP-1.42
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.03
LogP ≤ 5-1.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 158506606
CID 158506606
ethoxy-hydroperoxy-oxophosphanium
CID 87891677
magnesium;diethoxy(oxo)phosphanium;hydride
CID 175376025
sodium;diethoxy(oxo)phosphanium;hydride
CID 173097047
magnesium;ethoxy-methoxy-oxophosphanium;hydride
CID 175376011
CID 157268042
CID 157268042
ethoxy-methoxy-oxophosphanium;2-methylprop-2-enoic acid
CID 175582823
sodium;ethoxy-methyl-oxophosphanium;hydride
CID 175193862
ethoxy-oxo-(3-oxobutan-2-yl)phosphanium
CID 130464025
magnesium;dimethyl carbonate;hydride
CID 173223307
ethoxy-oxo-pentoxyphosphanium
CID 86182061
ethoxy-(2-methoxy-2-oxo-1-prop-2-enoyloxyethyl)-oxophosphanium
CID 130464050

Frequently Asked Questions

What is the IUPAC name of lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride?
The IUPAC name of lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride (CID 175403249) is lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride.
What is the SMILES notation for lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride?
The canonical SMILES for lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride is CCO[P+](=O)OC(=O)OC.[H-].[Li+].
What is the InChIKey of lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride?
The InChIKey is CZKZJXQQLJYIEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O5P.Li.H/c1-3-8-10(6)9-4(5)7-2;;/h3H2,1-2H3;;/q2*+1;-1.
What are the key properties of lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride?
lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride has a molecular weight of 175.03 g/mol, XLogP of -1.42, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride is sourced from PubChem (CID 175403249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).