trans-4,5-Dibromocyclohexene
TL;DR: trans-4,5-Dibromocyclohexene (CAS 42846-36-6) is a chemical compound with molecular formula C6H8Br2 and molecular weight 237.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S,5S)-4,5-dibromocyclohexene
Also Known As: trans-4,5-dibromocyclohexene, (4S,5S)-4,5-dibromocyclohexene, (4S,5S)-4,5-dibromocyclohex-1-ene, (4S)-4alpha,5beta-Dibromo-1-cyclohexene, J3.154.604D
| Molecular Formula | C6H8Br2 |
|---|---|
| Molecular Weight | 237.90 g/mol |
| LogP | 2.8634 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 237.89928 |
| Heavy Atoms | 8 |
| Complexity | 86.70166 |
Chemical Identifiers
| CAS Number | 42846-36-6 |
|---|---|
| SMILES | C1C=CC[C@@H]([C@H]1Br)Br |
Product Overview
trans-4,5-Dibromocyclohexene (CAS 42846-36-6), with molecular formula C6H8Br2 and molecular weight 237.90 g/mol. IUPAC: (4S,5S)-4,5-dibromocyclohexene.
Chemical Property Profile of trans-4,5-Dibromocyclohexene
Property Insights of trans-4,5-Dibromocyclohexene
The XLogP value of 2.8634 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-4,5-Dibromocyclohexene. With a topological polar surface area (TPSA) of 0.0 Ų, trans-4,5-Dibromocyclohexene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-4,5-Dibromocyclohexene 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 trans-4,5-Dibromocyclohexene?
The CAS number of trans-4,5-Dibromocyclohexene is 42846-36-6.
What is the molecular formula of trans-4,5-Dibromocyclohexene?
The molecular formula of trans-4,5-Dibromocyclohexene is C6H8Br2.
What is the molecular weight of trans-4,5-Dibromocyclohexene?
The molecular weight of trans-4,5-Dibromocyclohexene is 237.90 g/mol.
Where can I buy trans-4,5-Dibromocyclohexene?
You can request a quote for trans-4,5-Dibromocyclohexene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for trans-4,5-Dibromocyclohexene?
Yes, KEHONG BIO provides custom synthesis services for trans-4,5-Dibromocyclohexene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.