CID 134992350

C2H5BLi — CID 134992350

IUPAC
SMILES[B-]CC.[Li+]
InChIInChI=1S/C2H5B.Li/c1-2-3;/h2H2,1H3;/q-1;+1
InChIKeyZYKMZAIEOWGZSJ-UHFFFAOYSA-N
MW46.81 g/mol
LogP-2.40
Rot. Bonds

About CID 134992350

CID 134992350 (PubChem CID 134992350) has the molecular formula C2H5BLi and a molecular weight of 46.81 g/mol.

Molecular Properties

Compound NameCID 134992350
PubChem CID134992350
Molecular FormulaC2H5BLi
Molecular Weight46.81 g/mol
Exact Mass47.06
IUPAC Name
SMILES[B-]CC.[Li+]
InChIInChI=1S/C2H5B.Li/c1-2-3;/h2H2,1H3;/q-1;+1
InChIKeyZYKMZAIEOWGZSJ-UHFFFAOYSA-N
XLogP-2.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50046.81
LogP ≤ 5-2.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 134992350?
The IUPAC name of CID 134992350 (CID 134992350) is not available.
What is the SMILES notation for CID 134992350?
The canonical SMILES for CID 134992350 is [B-]CC.[Li+].
What is the InChIKey of CID 134992350?
The InChIKey is ZYKMZAIEOWGZSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5B.Li/c1-2-3;/h2H2,1H3;/q-1;+1.
What are the key properties of CID 134992350?
CID 134992350 has a molecular weight of 46.81 g/mol, XLogP of -2.40, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134992350 is sourced from PubChem (CID 134992350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).