Benzene, 1-chloro-4-silyl-

C6H4ClSi — CID 6335184

IUPAC—
SMILES[Si]c1ccc(Cl)cc1
InChIInChI=1S/C6H4ClSi/c7-5-1-3-6(8)4-2-5/h1-4H
InChIKeyIDUDYCIMDWCOOK-UHFFFAOYSA-N
MW139.64 g/mol
LogP1.13
Rot. Bonds

About Benzene, 1-chloro-4-silyl-

Benzene, 1-chloro-4-silyl- (PubChem CID 6335184) has the molecular formula C6H4ClSi and a molecular weight of 139.64 g/mol.

Molecular Properties

Compound NameBenzene, 1-chloro-4-silyl-
PubChem CID6335184
Molecular FormulaC6H4ClSi
Molecular Weight139.64 g/mol
Exact Mass138.98
IUPAC Name—
SMILES[Si]c1ccc(Cl)cc1
InChIInChI=1S/C6H4ClSi/c7-5-1-3-6(8)4-2-5/h1-4H
InChIKeyIDUDYCIMDWCOOK-UHFFFAOYSA-N
XLogP1.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.64
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze Benzene, 1-chloro-4-silyl- 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 Benzene, 1-chloro-4-silyl-?
The IUPAC name of Benzene, 1-chloro-4-silyl- (CID 6335184) is not available.
What is the SMILES notation for Benzene, 1-chloro-4-silyl-?
The canonical SMILES for Benzene, 1-chloro-4-silyl- is [Si]c1ccc(Cl)cc1.
What is the InChIKey of Benzene, 1-chloro-4-silyl-?
The InChIKey is IDUDYCIMDWCOOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4ClSi/c7-5-1-3-6(8)4-2-5/h1-4H.
What are the key properties of Benzene, 1-chloro-4-silyl-?
Benzene, 1-chloro-4-silyl- has a molecular weight of 139.64 g/mol, XLogP of 1.13, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Benzene, 1-chloro-4-silyl- is sourced from PubChem (CID 6335184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).