(3-Bromophenyl)(phenyl)sulfane
TL;DR: (3-Bromophenyl)(phenyl)sulfane (CAS 52089-10-8) is a chemical compound with molecular formula C12H9BrS and molecular weight 263.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-3-phenylsulfanylbenzene
Also Known As: 1-BROMO-3-(PHENYLSULFANYL)BENZENE, (3-BROMOPHENYL)(PHENYL)SULFANE, 3-Bromophenylphenyl sulfide, 1-bromo-3-(phenylthio)benzene, 3-bromophenyl phenyl sulfide
| Molecular Formula | C12H9BrS |
|---|---|
| Molecular Weight | 263.96 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 25.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.96082 |
| Heavy Atoms | 14 |
| Complexity | 166.0 |
Chemical Identifiers
| CAS Number | 52089-10-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=CC(=CC=C2)Br |
| InChIKey | FGPSFZNISIIDND-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3-Bromophenyl)(phenyl)sulfane (CAS 52089-10-8), with molecular formula C12H9BrS and molecular weight 263.96 g/mol. IUPAC: 1-bromo-3-phenylsulfanylbenzene.
Chemical Property Profile of (3-Bromophenyl)(phenyl)sulfane
Property Insights of (3-Bromophenyl)(phenyl)sulfane
The XLogP value of 4.7 indicates that (3-Bromophenyl)(phenyl)sulfane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.3 Ų, (3-Bromophenyl)(phenyl)sulfane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Bromophenyl)(phenyl)sulfane has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3-Bromophenyl)(phenyl)sulfane?
The CAS number of (3-Bromophenyl)(phenyl)sulfane is 52089-10-8.
What is the molecular formula of (3-Bromophenyl)(phenyl)sulfane?
The molecular formula of (3-Bromophenyl)(phenyl)sulfane is C12H9BrS.
What is the molecular weight of (3-Bromophenyl)(phenyl)sulfane?
The molecular weight of (3-Bromophenyl)(phenyl)sulfane is 263.96 g/mol.
Where can I buy (3-Bromophenyl)(phenyl)sulfane?
You can request a quote for (3-Bromophenyl)(phenyl)sulfane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Bromophenyl)(phenyl)sulfane?
Yes, KEHONG BIO provides custom synthesis services for (3-Bromophenyl)(phenyl)sulfane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.