(2E)-1-bromo-4-chloro-2-butene
TL;DR: (2E)-1-bromo-4-chloro-2-butene (CAS 102776-00-1) is a chemical compound with molecular formula C4H6BrCl and molecular weight 167.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-bromo-4-chlorobut-2-ene
Also Known As: 1-bromo-4-chlorobut-2-ene, 1-Bromo-4-chloro-2-butene, (E)-1-bromo-4-chlorobut-2-ene, (2E)-1-bromo-4-chloro-2-butene, Trans-1-Bromo-4-Chloro-2-Butene
| Molecular Formula | C4H6BrCl |
|---|---|
| Molecular Weight | 167.93 g/mol |
| LogP | 2.1763 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 167.93414 |
| Heavy Atoms | 6 |
| Complexity | 36.812744 |
Chemical Identifiers
| CAS Number | 102776-00-1 |
|---|---|
| SMILES | C(/C=C/CBr)Cl |
Product Overview
(2E)-1-bromo-4-chloro-2-butene (CAS 102776-00-1), with molecular formula C4H6BrCl and molecular weight 167.93 g/mol. IUPAC: (E)-1-bromo-4-chlorobut-2-ene.
Chemical Property Profile of (2E)-1-bromo-4-chloro-2-butene
Property Insights of (2E)-1-bromo-4-chloro-2-butene
The XLogP value of 2.1763 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2E)-1-bromo-4-chloro-2-butene. With a topological polar surface area (TPSA) of 0.0 Ų, (2E)-1-bromo-4-chloro-2-butene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-1-bromo-4-chloro-2-butene 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 (2E)-1-bromo-4-chloro-2-butene?
The CAS number of (2E)-1-bromo-4-chloro-2-butene is 102776-00-1.
What is the molecular formula of (2E)-1-bromo-4-chloro-2-butene?
The molecular formula of (2E)-1-bromo-4-chloro-2-butene is C4H6BrCl.
What is the molecular weight of (2E)-1-bromo-4-chloro-2-butene?
The molecular weight of (2E)-1-bromo-4-chloro-2-butene is 167.93 g/mol.
Where can I buy (2E)-1-bromo-4-chloro-2-butene?
You can request a quote for (2E)-1-bromo-4-chloro-2-butene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-1-bromo-4-chloro-2-butene?
Yes, KEHONG BIO provides custom synthesis services for (2E)-1-bromo-4-chloro-2-butene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.