3-Bromostilbene
TL;DR: 3-Bromostilbene (CAS 70626-28-7) is a chemical compound with molecular formula C14H11Br and molecular weight 258.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-3-(2-phenylethenyl)benzene
Also Known As: 3-bromostilbene, 1-bromo-3-(2-phenylethenyl)benzene, Benzene, 1-bromo-3-(2-phenylethenyl)-
| Molecular Formula | C14H11Br |
|---|---|
| Molecular Weight | 258.00 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 258.00443 |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 70626-28-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CC2=CC(=CC=C2)Br |
| InChIKey | MPYGIRDWORCFRS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Bromostilbene (CAS 70626-28-7), with molecular formula C14H11Br and molecular weight 258.00 g/mol. IUPAC: 1-bromo-3-(2-phenylethenyl)benzene.
Chemical Property Profile of 3-Bromostilbene
Property Insights of 3-Bromostilbene
The XLogP value of 4.9 indicates that 3-Bromostilbene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Bromostilbene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromostilbene has 0 hydrogen bond donor(s) and 0 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-Bromostilbene?
The CAS number of 3-Bromostilbene is 70626-28-7.
What is the molecular formula of 3-Bromostilbene?
The molecular formula of 3-Bromostilbene is C14H11Br.
What is the molecular weight of 3-Bromostilbene?
The molecular weight of 3-Bromostilbene is 258.00 g/mol.
Where can I buy 3-Bromostilbene?
You can request a quote for 3-Bromostilbene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromostilbene?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromostilbene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.