CID 156766112

C5H11BrSi — CID 156766112

IUPAC—
SMILESC[Si]CCCCBr
InChIInChI=1S/C5H11BrSi/c1-7-5-3-2-4-6/h2-5H2,1H3
InChIKeySAMVCGFKYXNRGM-UHFFFAOYSA-N
MW179.13 g/mol
LogP2.33
Rot. Bonds4

About CID 156766112

CID 156766112 (PubChem CID 156766112) has the molecular formula C5H11BrSi and a molecular weight of 179.13 g/mol.

Molecular Properties

Compound NameCID 156766112
PubChem CID156766112
Molecular FormulaC5H11BrSi
Molecular Weight179.13 g/mol
Exact Mass177.98
IUPAC Name—
SMILESC[Si]CCCCBr
InChIInChI=1S/C5H11BrSi/c1-7-5-3-2-4-6/h2-5H2,1H3
InChIKeySAMVCGFKYXNRGM-UHFFFAOYSA-N
XLogP2.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.13
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze CID 156766112 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of CID 156766112?
The IUPAC name of CID 156766112 (CID 156766112) is not available.
What is the SMILES notation for CID 156766112?
The canonical SMILES for CID 156766112 is C[Si]CCCCBr.
What is the InChIKey of CID 156766112?
The InChIKey is SAMVCGFKYXNRGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11BrSi/c1-7-5-3-2-4-6/h2-5H2,1H3.
What are the key properties of CID 156766112?
CID 156766112 has a molecular weight of 179.13 g/mol, XLogP of 2.33, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 156766112 is sourced from PubChem (CID 156766112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).