1,2-Dibromoheptane
TL;DR: 1,2-Dibromoheptane (CAS 42474-21-5) is a chemical compound with molecular formula C7H14Br2 and molecular weight 255.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2-dibromoheptane
Also Known As: 1,2-Dibromoheptane, 1,2-dibromo-heptane, Heptane, 1,2-dibromo-, RefChem:71830
| Molecular Formula | C7H14Br2 |
|---|---|
| Molecular Weight | 255.95 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 255.94623 |
| Heavy Atoms | 9 |
| Complexity | 54.0 |
Chemical Identifiers
| CAS Number | 42474-21-5 |
|---|---|
| SMILES | CCCCCC(CBr)Br |
| InChIKey | CKVJSNYSBIZAAE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Dibromoheptane (CAS 42474-21-5), with molecular formula C7H14Br2 and molecular weight 255.95 g/mol. IUPAC: 1,2-dibromoheptane.
Chemical Property Profile of 1,2-Dibromoheptane
Property Insights of 1,2-Dibromoheptane
The XLogP value of 4.1 indicates that 1,2-Dibromoheptane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Dibromoheptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Dibromoheptane 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 1,2-Dibromoheptane?
The CAS number of 1,2-Dibromoheptane is 42474-21-5.
What is the molecular formula of 1,2-Dibromoheptane?
The molecular formula of 1,2-Dibromoheptane is C7H14Br2.
What is the molecular weight of 1,2-Dibromoheptane?
The molecular weight of 1,2-Dibromoheptane is 255.95 g/mol.
Where can I buy 1,2-Dibromoheptane?
You can request a quote for 1,2-Dibromoheptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dibromoheptane?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dibromoheptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.