5-Benzyloxy-2-bromotoluene
TL;DR: 5-Benzyloxy-2-bromotoluene (CAS 17671-75-9) is a chemical compound with molecular formula C14H13BrO and molecular weight 276.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2-methyl-4-phenylmethoxybenzene
Also Known As: 5-Benzyloxy-2-bromotoluene, 4-(benzyloxy)-1-bromo-2-methylbenzene, 5-(Benzyloxy)-2-bromotoluene, 1-bromo-2-methyl-4-phenylmethoxybenzene, benzene, 1-bromo-2-methyl-4-(phenylmethoxy)-
| Molecular Formula | C14H13BrO |
|---|---|
| Molecular Weight | 276.01 g/mol |
| LogP | 4.33652 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 276.01498 |
| Heavy Atoms | 16 |
| Complexity | 465.41647 |
Chemical Identifiers
| CAS Number | 17671-75-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)OCC2=CC=CC=C2)Br |
Product Overview
5-Benzyloxy-2-bromotoluene (CAS 17671-75-9), with molecular formula C14H13BrO and molecular weight 276.01 g/mol. IUPAC: 1-bromo-2-methyl-4-phenylmethoxybenzene.
Chemical Property Profile of 5-Benzyloxy-2-bromotoluene
Property Insights of 5-Benzyloxy-2-bromotoluene
The XLogP value of 4.33652 indicates that 5-Benzyloxy-2-bromotoluene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 5-Benzyloxy-2-bromotoluene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Benzyloxy-2-bromotoluene has 0 hydrogen bond donor(s) and 1 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 5-Benzyloxy-2-bromotoluene?
The CAS number of 5-Benzyloxy-2-bromotoluene is 17671-75-9.
What is the molecular formula of 5-Benzyloxy-2-bromotoluene?
The molecular formula of 5-Benzyloxy-2-bromotoluene is C14H13BrO.
What is the molecular weight of 5-Benzyloxy-2-bromotoluene?
The molecular weight of 5-Benzyloxy-2-bromotoluene is 276.01 g/mol.
Where can I buy 5-Benzyloxy-2-bromotoluene?
You can request a quote for 5-Benzyloxy-2-bromotoluene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzyloxy-2-bromotoluene?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzyloxy-2-bromotoluene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.