1-甲氧基-2-(1-甲基丙基)苯
TL;DR: 1-甲氧基-2-(1-甲基丙基)苯 (CAS 18272-71-4) is a chemical compound with molecular formula C11H16O and molecular weight 164.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-甲氧基-2-(1-甲基丙基)苯
1-butan-2-yl-2-methoxybenzene
Also Known As: o-s-butylanisole, o-sec-Butylanisole, o-(sec-Butyl)anisole, 2-sec-butyl-anisole, Benzene, 1-methoxy-2-(1-methylpropyl)-
| Molecular Formula | C11H16O |
|---|---|
| Molecular Weight | 164.12 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.12012 |
| Heavy Atoms | 12 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 18272-71-4 |
|---|---|
| SMILES | CCC(C)C1=CC=CC=C1OC |
| InChIKey | XGEOZYQKQHPUFZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-甲氧基-2-(1-甲基丙基)苯 (CAS 18272-71-4), with molecular formula C11H16O and molecular weight 164.12 g/mol. IUPAC: 1-butan-2-yl-2-methoxybenzene.
Chemical Property Profile of 1-甲氧基-2-(1-甲基丙基)苯
Property Insights of 1-甲氧基-2-(1-甲基丙基)苯
The XLogP value of 3.7 indicates that 1-甲氧基-2-(1-甲基丙基)苯 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-甲氧基-2-(1-甲基丙基)苯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-甲氧基-2-(1-甲基丙基)苯 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 1-甲氧基-2-(1-甲基丙基)苯?
The CAS number of 1-甲氧基-2-(1-甲基丙基)苯 is 18272-71-4.
What is the molecular formula of 1-甲氧基-2-(1-甲基丙基)苯?
The molecular formula of 1-甲氧基-2-(1-甲基丙基)苯 is C11H16O.
What is the molecular weight of 1-甲氧基-2-(1-甲基丙基)苯?
The molecular weight of 1-甲氧基-2-(1-甲基丙基)苯 is 164.12 g/mol.
Where can I buy 1-甲氧基-2-(1-甲基丙基)苯?
You can request a quote for 1-甲氧基-2-(1-甲基丙基)苯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-甲氧基-2-(1-甲基丙基)苯?
Yes, KEHONG BIO provides custom synthesis services for 1-甲氧基-2-(1-甲基丙基)苯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.