1-溴庚烷
TL;DR: 1-溴庚烷 (CAS 629-04-9) is a chemical compound with molecular formula C7H15Br and molecular weight 178.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-溴庚烷
1-bromoheptane
Also Known As: 1-BROMOHEPTANE, Heptyl bromide, n-Heptyl bromide, Heptane, 1-bromo-, bromoheptane
| Molecular Formula | C7H15Br |
|---|---|
| Molecular Weight | 178.04 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 178.0357 |
| Heavy Atoms | 8 |
| Complexity | 35.0 |
| Vapor Pressure | 1.27 [mmHg] |
Chemical Identifiers
| CAS Number | 629-04-9 |
|---|---|
| SMILES | CCCCCCCBr |
| InChIKey | LSXKDWGTSHCFPP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-溴庚烷 (CAS 629-04-9), with molecular formula C7H15Br and molecular weight 178.04 g/mol. IUPAC: 1-bromoheptane.
Chemical Property Profile of 1-溴庚烷
Property Insights of 1-溴庚烷
The XLogP value of 4.4 indicates that 1-溴庚烷 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-溴庚烷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-溴庚烷 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-溴庚烷?
The CAS number of 1-溴庚烷 is 629-04-9.
What is the molecular formula of 1-溴庚烷?
The molecular formula of 1-溴庚烷 is C7H15Br.
What is the molecular weight of 1-溴庚烷?
The molecular weight of 1-溴庚烷 is 178.04 g/mol.
Where can I buy 1-溴庚烷?
You can request a quote for 1-溴庚烷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-溴庚烷?
Yes, KEHONG BIO provides custom synthesis services for 1-溴庚烷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.