(3-Bromoprop-1-en-2-yl)benzene
TL;DR: (3-Bromoprop-1-en-2-yl)benzene (CAS 3360-54-1) 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.
3-bromoprop-1-en-2-ylbenzene
Also Known As: (3-bromoprop-1-en-2-yl)benzene, -benzene, 3-bromoprop-1-en-2-ylbenzene, alpha-bromomethylstyrene, 2-phenylallyl bromide
| Molecular Formula | C9H9Br |
|---|---|
| Molecular Weight | 195.99 g/mol |
| LogP | 3.7 |
| 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 | 112.0 |
Chemical Identifiers
| CAS Number | 3360-54-1 |
|---|---|
| SMILES | C=C(CBr)C1=CC=CC=C1 |
| InChIKey | RMMHOFFPGKSRDI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(3-Bromoprop-1-en-2-yl)benzene (CAS 3360-54-1), with molecular formula C9H9Br and molecular weight 195.99 g/mol. IUPAC: 3-bromoprop-1-en-2-ylbenzene.
Chemical Property Profile of (3-Bromoprop-1-en-2-yl)benzene
Property Insights of (3-Bromoprop-1-en-2-yl)benzene
The XLogP value of 3.7 indicates that (3-Bromoprop-1-en-2-yl)benzene 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-Bromoprop-1-en-2-yl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Bromoprop-1-en-2-yl)benzene 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-Bromoprop-1-en-2-yl)benzene?
The CAS number of (3-Bromoprop-1-en-2-yl)benzene is 3360-54-1.
What is the molecular formula of (3-Bromoprop-1-en-2-yl)benzene?
The molecular formula of (3-Bromoprop-1-en-2-yl)benzene is C9H9Br.
What is the molecular weight of (3-Bromoprop-1-en-2-yl)benzene?
The molecular weight of (3-Bromoprop-1-en-2-yl)benzene is 195.99 g/mol.
Where can I buy (3-Bromoprop-1-en-2-yl)benzene?
You can request a quote for (3-Bromoprop-1-en-2-yl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Bromoprop-1-en-2-yl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (3-Bromoprop-1-en-2-yl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.