(4-bromophenyl)-trimethylstannane

C9H13BrSn — CID 627750

IUPAC(4-bromophenyl)-trimethylstannane
SMILESC[Sn](C)(C)c1ccc(Br)cc1
InChIInChI=1S/C6H4Br.3CH3.Sn/c7-6-4-2-1-3-5-6;;;;/h2-5H;3*1H3;
InChIKeyWFQUNOJQEKEOSF-UHFFFAOYSA-N
MW319.82 g/mol
LogP2.99
Rot. Bonds1

About (4-bromophenyl)-trimethylstannane

(4-bromophenyl)-trimethylstannane (PubChem CID 627750) has the molecular formula C9H13BrSn and a molecular weight of 319.82 g/mol. Its IUPAC name is (4-bromophenyl)-trimethylstannane.

Molecular Properties

Compound Name(4-bromophenyl)-trimethylstannane
PubChem CID627750
Molecular FormulaC9H13BrSn
Molecular Weight319.82 g/mol
Exact Mass319.92
IUPAC Name(4-bromophenyl)-trimethylstannane
SMILESC[Sn](C)(C)c1ccc(Br)cc1
InChIInChI=1S/C6H4Br.3CH3.Sn/c7-6-4-2-1-3-5-6;;;;/h2-5H;3*1H3;
InChIKeyWFQUNOJQEKEOSF-UHFFFAOYSA-N
XLogP2.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.82
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze (4-bromophenyl)-trimethylstannane 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 (4-bromophenyl)-trimethylstannane?
The IUPAC name of (4-bromophenyl)-trimethylstannane (CID 627750) is (4-bromophenyl)-trimethylstannane.
What is the SMILES notation for (4-bromophenyl)-trimethylstannane?
The canonical SMILES for (4-bromophenyl)-trimethylstannane is C[Sn](C)(C)c1ccc(Br)cc1.
What is the InChIKey of (4-bromophenyl)-trimethylstannane?
The InChIKey is WFQUNOJQEKEOSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Br.3CH3.Sn/c7-6-4-2-1-3-5-6;;;;/h2-5H;3*1H3;.
What are the key properties of (4-bromophenyl)-trimethylstannane?
(4-bromophenyl)-trimethylstannane has a molecular weight of 319.82 g/mol, XLogP of 2.99, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromophenyl)-trimethylstannane is sourced from PubChem (CID 627750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).