Cinnamyl bromide
TL;DR: Cinnamyl bromide (CAS 47465-97-4) is a chemical compound with molecular formula C9H9Br and molecular weight 195.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-3-bromoprop-1-enyl]benzene
Also Known As: Cinnamyl bromide, (3-bromoprop-1-en-1-yl)benzene, (E)-(3-Bromoprop-1-en-1-yl)benzene, 3-Bromo-1-phenyl-1-propene, E-cinnamyl bromide
| Molecular Formula | C9H9Br |
|---|---|
| Molecular Weight | 195.99 g/mol |
| LogP | 3.0947 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 195.98875 |
| Heavy Atoms | 10 |
| Complexity | 201.22807 |
Chemical Identifiers
| CAS Number | 47465-97-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/CBr |
Product Overview
Cinnamyl bromide (CAS 47465-97-4), with molecular formula C9H9Br and molecular weight 195.99 g/mol. IUPAC: [(E)-3-bromoprop-1-enyl]benzene.
Chemical Property Profile of Cinnamyl bromide
Property Insights of Cinnamyl bromide
The XLogP value of 3.0947 indicates that Cinnamyl bromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Cinnamyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cinnamyl bromide 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 Cinnamyl bromide?
The CAS number of Cinnamyl bromide is 47465-97-4.
What is the molecular formula of Cinnamyl bromide?
The molecular formula of Cinnamyl bromide is C9H9Br.
What is the molecular weight of Cinnamyl bromide?
The molecular weight of Cinnamyl bromide is 195.99 g/mol.
Where can I buy Cinnamyl bromide?
You can request a quote for Cinnamyl bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinnamyl bromide?
Yes, KEHONG BIO provides custom synthesis services for Cinnamyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.