1-(4-Bromophenoxy)heptane
TL;DR: 1-(4-Bromophenoxy)heptane (CAS 123732-04-7) is a chemical compound with molecular formula C13H19BrO and molecular weight 270.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4-heptoxybenzene
Also Known As: 1-(4-bromophenoxy)heptane, 1-bromo-4-(heptyloxy)benzene, 1-bromo-4-heptoxybenzene, 4-N-Heptyloxybromobenzene, 1-Bromo-4-heptyloxybenzene
| Molecular Formula | C13H19BrO |
|---|---|
| Molecular Weight | 270.06 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 270.06192 |
| Heavy Atoms | 15 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 123732-04-7 |
|---|---|
| SMILES | CCCCCCCOC1=CC=C(C=C1)Br |
| InChIKey | DSCVEUSJTAFLBF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Bromophenoxy)heptane (CAS 123732-04-7), with molecular formula C13H19BrO and molecular weight 270.06 g/mol. IUPAC: 1-bromo-4-heptoxybenzene.
Chemical Property Profile of 1-(4-Bromophenoxy)heptane
Property Insights of 1-(4-Bromophenoxy)heptane
The XLogP value of 5.6 indicates that 1-(4-Bromophenoxy)heptane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 1-(4-Bromophenoxy)heptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Bromophenoxy)heptane has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Bromophenoxy)heptane?
The CAS number of 1-(4-Bromophenoxy)heptane is 123732-04-7.
What is the molecular formula of 1-(4-Bromophenoxy)heptane?
The molecular formula of 1-(4-Bromophenoxy)heptane is C13H19BrO.
What is the molecular weight of 1-(4-Bromophenoxy)heptane?
The molecular weight of 1-(4-Bromophenoxy)heptane is 270.06 g/mol.
Where can I buy 1-(4-Bromophenoxy)heptane?
You can request a quote for 1-(4-Bromophenoxy)heptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Bromophenoxy)heptane?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Bromophenoxy)heptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.