CID 158506606

C4H8LiO5P+ — CID 158506606

IUPAC—
SMILESCCO[P+](=O)OC(=O)OC.[Li]
InChIInChI=1S/C4H8O5P.Li/c1-3-8-10(6)9-4(5)7-2;/h3H2,1-2H3;/q+1;
InChIKeyOQYKBJCVLWDHLB-UHFFFAOYSA-N
MW174.02 g/mol
LogP1.08
Rot. Bonds3

About CID 158506606

CID 158506606 (PubChem CID 158506606) has the molecular formula C4H8LiO5P+ and a molecular weight of 174.02 g/mol.

Molecular Properties

Compound NameCID 158506606
PubChem CID158506606
Molecular FormulaC4H8LiO5P+
Molecular Weight174.02 g/mol
Exact Mass174.03
IUPAC Name—
SMILESCCO[P+](=O)OC(=O)OC.[Li]
InChIInChI=1S/C4H8O5P.Li/c1-3-8-10(6)9-4(5)7-2;/h3H2,1-2H3;/q+1;
InChIKeyOQYKBJCVLWDHLB-UHFFFAOYSA-N
XLogP1.08
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.02
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

lithium;ethoxy-methoxycarbonyloxy-oxophosphanium;hydride
CID 175403249
ethoxy-hydroperoxy-oxophosphanium
CID 87891677
CID 157268042
CID 157268042
magnesium;diethoxy(oxo)phosphanium;hydride
CID 175376025
sodium;diethoxy(oxo)phosphanium;hydride
CID 173097047
magnesium;ethoxy-methoxy-oxophosphanium;hydride
CID 175376011
ethoxy-methoxy-oxophosphanium;2-methylprop-2-enoic acid
CID 175582823
ethoxy-oxo-(3-oxobutan-2-yl)phosphanium
CID 130464025
ethoxy-oxo-pentoxyphosphanium
CID 86182061
buta-1,3-diene;diethoxy(oxo)phosphanium
CID 88766369
ethanol;ethyl methyl carbonate
CID 161101393
diethyl carbonate;dimethyl carbonate;ethyl methyl carbonate
CID 87546918

Frequently Asked Questions

What is the IUPAC name of CID 158506606?
The IUPAC name of CID 158506606 (CID 158506606) is not available.
What is the SMILES notation for CID 158506606?
The canonical SMILES for CID 158506606 is CCO[P+](=O)OC(=O)OC.[Li].
What is the InChIKey of CID 158506606?
The InChIKey is OQYKBJCVLWDHLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8O5P.Li/c1-3-8-10(6)9-4(5)7-2;/h3H2,1-2H3;/q+1;.
What are the key properties of CID 158506606?
CID 158506606 has a molecular weight of 174.02 g/mol, XLogP of 1.08, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 158506606 is sourced from PubChem (CID 158506606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).