1-(Benzyloxy)-4-(3-bromopropyl)benzene
TL;DR: 1-(Benzyloxy)-4-(3-bromopropyl)benzene (CAS 167091-73-8) is a chemical compound with molecular formula C16H17BrO and molecular weight 304.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromopropyl)-4-phenylmethoxybenzene
Also Known As: 1-((4-(3-BROMOPROPYL)PHENOXY)METHYL)BENZENE, 1-(Benzyloxy)-4-(3-bromopropyl)benzene, 1-(3-bromopropyl)-4-phenylmethoxybenzene, 1-benzyloxy-4-(3-bromopropyl)benzene, Benzene, 1-(3-bromopropyl)-4-benzyloxy-
| Molecular Formula | C16H17BrO |
|---|---|
| Molecular Weight | 304.05 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 304.0463 |
| Heavy Atoms | 18 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 167091-73-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)CCCBr |
| InChIKey | IBZKTVPDAHUHSV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Benzyloxy)-4-(3-bromopropyl)benzene (CAS 167091-73-8), with molecular formula C16H17BrO and molecular weight 304.05 g/mol. IUPAC: 1-(3-bromopropyl)-4-phenylmethoxybenzene.
Chemical Property Profile of 1-(Benzyloxy)-4-(3-bromopropyl)benzene
Property Insights of 1-(Benzyloxy)-4-(3-bromopropyl)benzene
The XLogP value of 5.2 indicates that 1-(Benzyloxy)-4-(3-bromopropyl)benzene 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-(Benzyloxy)-4-(3-bromopropyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Benzyloxy)-4-(3-bromopropyl)benzene 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-(Benzyloxy)-4-(3-bromopropyl)benzene?
The CAS number of 1-(Benzyloxy)-4-(3-bromopropyl)benzene is 167091-73-8.
What is the molecular formula of 1-(Benzyloxy)-4-(3-bromopropyl)benzene?
The molecular formula of 1-(Benzyloxy)-4-(3-bromopropyl)benzene is C16H17BrO.
What is the molecular weight of 1-(Benzyloxy)-4-(3-bromopropyl)benzene?
The molecular weight of 1-(Benzyloxy)-4-(3-bromopropyl)benzene is 304.05 g/mol.
Where can I buy 1-(Benzyloxy)-4-(3-bromopropyl)benzene?
You can request a quote for 1-(Benzyloxy)-4-(3-bromopropyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzyloxy)-4-(3-bromopropyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzyloxy)-4-(3-bromopropyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.