CID 139031353

C3H6Li — CID 139031353

IUPAC—
SMILESC=CC.[Li]
InChIInChI=1S/C3H6.Li/c1-3-2;/h3H,1H2,2H3;
InChIKeyUIGQEZZSKOINIE-UHFFFAOYSA-N
MW49.02 g/mol
LogP0.81
Rot. Bonds

About CID 139031353

CID 139031353 (PubChem CID 139031353) has the molecular formula C3H6Li and a molecular weight of 49.02 g/mol.

Molecular Properties

Compound NameCID 139031353
PubChem CID139031353
Molecular FormulaC3H6Li
Molecular Weight49.02 g/mol
Exact Mass49.06
IUPAC Name—
SMILESC=CC.[Li]
InChIInChI=1S/C3H6.Li/c1-3-2;/h3H,1H2,2H3;
InChIKeyUIGQEZZSKOINIE-UHFFFAOYSA-N
XLogP0.81
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 ≤ 50.81
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 CID 139031353?
The IUPAC name of CID 139031353 (CID 139031353) is not available.
What is the SMILES notation for CID 139031353?
The canonical SMILES for CID 139031353 is C=CC.[Li].
What is the InChIKey of CID 139031353?
The InChIKey is UIGQEZZSKOINIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6.Li/c1-3-2;/h3H,1H2,2H3;.
What are the key properties of CID 139031353?
CID 139031353 has a molecular weight of 49.02 g/mol, XLogP of 0.81, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 139031353 is sourced from PubChem (CID 139031353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).