(E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene
TL;DR: (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene (CAS 210113-74-9) is a chemical compound with molecular formula C9H7BrF2 and molecular weight 231.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-3-bromoprop-1-enyl]-3,5-difluorobenzene
Also Known As: 3,5-Difluorocinnamyl bromide, 1-[(1e)-3-bromo-1-propen-1-yl]-3,5-difluoro-benzene, (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene, 1-[(E)-3-bromoprop-1-enyl]-3,5-difluorobenzene, 1-(3-bromoprop-1-enyl)-3,5-difluoro-benzene
| Molecular Formula | C9H7BrF2 |
|---|---|
| Molecular Weight | 231.97 g/mol |
| LogP | 3.3729 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.96992 |
| Heavy Atoms | 12 |
| Complexity | 274.33005 |
Chemical Identifiers
| CAS Number | 210113-74-9 |
|---|---|
| SMILES | C1=C(C=C(C=C1F)F)/C=C/CBr |
Product Overview
(E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene (CAS 210113-74-9), with molecular formula C9H7BrF2 and molecular weight 231.97 g/mol. IUPAC: 1-[(E)-3-bromoprop-1-enyl]-3,5-difluorobenzene.
Chemical Property Profile of (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene
Property Insights of (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene
The XLogP value of 3.3729 indicates that (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene 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 (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene?
The CAS number of (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene is 210113-74-9.
What is the molecular formula of (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene?
The molecular formula of (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene is C9H7BrF2.
What is the molecular weight of (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene?
The molecular weight of (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene is 231.97 g/mol.
Where can I buy (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene?
You can request a quote for (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene?
Yes, KEHONG BIO provides custom synthesis services for (E)-1-(3-bromoprop-1-en-1-yl)-3,5-difluorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.