lithium;bis(prop-1-enyl) carbonate;hydride

C7H11LiO3 — CID 174406437

IUPAClithium;bis(prop-1-enyl) carbonate;hydride
SMILESCC=COC(=O)OC=CC.[H-].[Li+]
InChIInChI=1S/C7H10O3.Li.H/c1-3-5-9-7(8)10-6-4-2;;/h3-6H,1-2H3;;/q;+1;-1
InChIKeyKZWVSQTVUODGPZ-UHFFFAOYSA-N
MW150.10 g/mol
LogP-0.68
Rot. Bonds2

About lithium;bis(prop-1-enyl) carbonate;hydride

lithium;bis(prop-1-enyl) carbonate;hydride (PubChem CID 174406437) has the molecular formula C7H11LiO3 and a molecular weight of 150.10 g/mol. Its IUPAC name is lithium;bis(prop-1-enyl) carbonate;hydride.

Molecular Properties

Compound Namelithium;bis(prop-1-enyl) carbonate;hydride
PubChem CID174406437
Molecular FormulaC7H11LiO3
Molecular Weight150.10 g/mol
Exact Mass150.09
IUPAC Namelithium;bis(prop-1-enyl) carbonate;hydride
SMILESCC=COC(=O)OC=CC.[H-].[Li+]
InChIInChI=1S/C7H10O3.Li.H/c1-3-5-9-7(8)10-6-4-2;;/h3-6H,1-2H3;;/q;+1;-1
InChIKeyKZWVSQTVUODGPZ-UHFFFAOYSA-N
XLogP-0.68
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.10
LogP ≤ 5-0.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of lithium;bis(prop-1-enyl) carbonate;hydride?
The IUPAC name of lithium;bis(prop-1-enyl) carbonate;hydride (CID 174406437) is lithium;bis(prop-1-enyl) carbonate;hydride.
What is the SMILES notation for lithium;bis(prop-1-enyl) carbonate;hydride?
The canonical SMILES for lithium;bis(prop-1-enyl) carbonate;hydride is CC=COC(=O)OC=CC.[H-].[Li+].
What is the InChIKey of lithium;bis(prop-1-enyl) carbonate;hydride?
The InChIKey is KZWVSQTVUODGPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O3.Li.H/c1-3-5-9-7(8)10-6-4-2;;/h3-6H,1-2H3;;/q;+1;-1.
What are the key properties of lithium;bis(prop-1-enyl) carbonate;hydride?
lithium;bis(prop-1-enyl) carbonate;hydride has a molecular weight of 150.10 g/mol, XLogP of -0.68, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;bis(prop-1-enyl) carbonate;hydride is sourced from PubChem (CID 174406437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).