4-甲氧基溴化苄
TL;DR: 4-甲氧基溴化苄 (CAS 33098-86-1) is a chemical compound with molecular formula C8H9BrO and molecular weight 199.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-甲氧基溴化苄
1-(bromomethyl)-4-methoxybenzene
Also Known As: 4-Methoxybenzyl bromide, 1-(Bromomethyl)-4-methoxybenzene, null, p-Methoxybenzyl bromide, 4-Methoxybenzylbromide
| Molecular Formula | C8H9BrO |
|---|---|
| Molecular Weight | 199.98 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 199.98367 |
| Heavy Atoms | 10 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 33098-86-1 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CBr |
| InChIKey | GIGRWGTZFONRKA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-甲氧基溴化苄 (CAS 33098-86-1), with molecular formula C8H9BrO and molecular weight 199.98 g/mol. IUPAC: 1-(bromomethyl)-4-methoxybenzene.
Chemical Property Profile of 4-甲氧基溴化苄
Property Insights of 4-甲氧基溴化苄
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-甲氧基溴化苄. With a topological polar surface area (TPSA) of 9.2 Ų, 4-甲氧基溴化苄 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-甲氧基溴化苄 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 4-甲氧基溴化苄?
The CAS number of 4-甲氧基溴化苄 is 33098-86-1.
What is the molecular formula of 4-甲氧基溴化苄?
The molecular formula of 4-甲氧基溴化苄 is C8H9BrO.
What is the molecular weight of 4-甲氧基溴化苄?
The molecular weight of 4-甲氧基溴化苄 is 199.98 g/mol.
Where can I buy 4-甲氧基溴化苄?
You can request a quote for 4-甲氧基溴化苄 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-甲氧基溴化苄?
Yes, KEHONG BIO provides custom synthesis services for 4-甲氧基溴化苄 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.