lithium prop-1-ene

C3H6Li+ — CID 22491529

IUPAClithium prop-1-ene
SMILESC=CC.[Li+]
InChIInChI=1S/C3H6.Li/c1-3-2;/h3H,1H2,2H3;/q;+1
InChIKeyIOIZGPCHXSSUND-UHFFFAOYSA-N
MW49.02 g/mol
LogP-1.80
Rot. Bonds

About lithium prop-1-ene

lithium prop-1-ene (PubChem CID 22491529) has the molecular formula C3H6Li+ and a molecular weight of 49.02 g/mol. Its IUPAC name is lithium prop-1-ene.

Molecular Properties

Compound Namelithium prop-1-ene
PubChem CID22491529
Molecular FormulaC3H6Li+
Molecular Weight49.02 g/mol
Exact Mass49.06
IUPAC Namelithium prop-1-ene
SMILESC=CC.[Li+]
InChIInChI=1S/C3H6.Li/c1-3-2;/h3H,1H2,2H3;/q;+1
InChIKeyIOIZGPCHXSSUND-UHFFFAOYSA-N
XLogP-1.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50049.02
LogP ≤ 5-1.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium prop-1-ene?
The IUPAC name of lithium prop-1-ene (CID 22491529) is lithium prop-1-ene.
What is the SMILES notation for lithium prop-1-ene?
The canonical SMILES for lithium prop-1-ene is C=CC.[Li+].
What is the InChIKey of lithium prop-1-ene?
The InChIKey is IOIZGPCHXSSUND-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6.Li/c1-3-2;/h3H,1H2,2H3;/q;+1.
What are the key properties of lithium prop-1-ene?
lithium prop-1-ene has a molecular weight of 49.02 g/mol, XLogP of -1.80, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium prop-1-ene is sourced from PubChem (CID 22491529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).