(Sec-butoxymethoxy)benzene
TL;DR: (Sec-butoxymethoxy)benzene (CAS 5107-69-7) is a chemical compound with molecular formula C11H16O2 and molecular weight 180.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butan-2-yloxymethoxybenzene
Also Known As: (Sec-butoxymethoxy)benzene, sec-Butoxyphenoxymethane, Methane, sec-butoxyphenoxy-, butan-2-yloxymethoxybenzene, (Sec-butoxymethoxy)benzene #
| Molecular Formula | C11H16O2 |
|---|---|
| Molecular Weight | 180.12 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 180.11504 |
| Heavy Atoms | 13 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 5107-69-7 |
|---|---|
| SMILES | CCC(C)OCOC1=CC=CC=C1 |
| InChIKey | YDYCJNQWJCFHRZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(Sec-butoxymethoxy)benzene (CAS 5107-69-7), with molecular formula C11H16O2 and molecular weight 180.12 g/mol. IUPAC: butan-2-yloxymethoxybenzene.
Chemical Property Profile of (Sec-butoxymethoxy)benzene
Property Insights of (Sec-butoxymethoxy)benzene
The XLogP value of 3.2 indicates that (Sec-butoxymethoxy)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, (Sec-butoxymethoxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Sec-butoxymethoxy)benzene has 0 hydrogen bond donor(s) and 2 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 (Sec-butoxymethoxy)benzene?
The CAS number of (Sec-butoxymethoxy)benzene is 5107-69-7.
What is the molecular formula of (Sec-butoxymethoxy)benzene?
The molecular formula of (Sec-butoxymethoxy)benzene is C11H16O2.
What is the molecular weight of (Sec-butoxymethoxy)benzene?
The molecular weight of (Sec-butoxymethoxy)benzene is 180.12 g/mol.
Where can I buy (Sec-butoxymethoxy)benzene?
You can request a quote for (Sec-butoxymethoxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Sec-butoxymethoxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for (Sec-butoxymethoxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.