1,5-Dibromo-3-phenylhexane
TL;DR: 1,5-Dibromo-3-phenylhexane (CAS 79023-47-5) is a chemical compound with molecular formula C12H16Br2 and molecular weight 317.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dibromohexan-3-ylbenzene
Also Known As: 1,5-Dibromo-3-phenylhexane, 1,5-dibromohexan-3-ylbenzene, (1,5-DIBROMOHEXAN-3-YL)BENZENE, Benzene, [3-bromo-1-(2-bromoethyl)butyl]-, [3-Bromo-1-(2-bromoethyl)butyl]benzene #
| Molecular Formula | C12H16Br2 |
|---|---|
| Molecular Weight | 317.96 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 317.96188 |
| Heavy Atoms | 14 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 79023-47-5 |
|---|---|
| SMILES | CC(CC(CCBr)C1=CC=CC=C1)Br |
| InChIKey | MOHUNOORRNWDCU-UHFFFAOYSA-N |
Product Overview
1,5-Dibromo-3-phenylhexane (CAS 79023-47-5), with molecular formula C12H16Br2 and molecular weight 317.96 g/mol. IUPAC: 1,5-dibromohexan-3-ylbenzene.
Chemical Property Profile of 1,5-Dibromo-3-phenylhexane
Property Insights of 1,5-Dibromo-3-phenylhexane
The XLogP value of 4.6 indicates that 1,5-Dibromo-3-phenylhexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,5-Dibromo-3-phenylhexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Dibromo-3-phenylhexane 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 1,5-Dibromo-3-phenylhexane?
The CAS number of 1,5-Dibromo-3-phenylhexane is 79023-47-5.
What is the molecular formula of 1,5-Dibromo-3-phenylhexane?
The molecular formula of 1,5-Dibromo-3-phenylhexane is C12H16Br2.
What is the molecular weight of 1,5-Dibromo-3-phenylhexane?
The molecular weight of 1,5-Dibromo-3-phenylhexane is 317.96 g/mol.
Where can I buy 1,5-Dibromo-3-phenylhexane?
You can request a quote for 1,5-Dibromo-3-phenylhexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Dibromo-3-phenylhexane?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Dibromo-3-phenylhexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.