1-Benzyl-3-methoxybenzene
TL;DR: 1-Benzyl-3-methoxybenzene (CAS 23450-27-3) is a chemical compound with molecular formula C14H14O and molecular weight 198.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-methoxybenzene
Also Known As: 1-Benzyl-3-methoxybenzene, 3-Benzylanisole, 3-Methoxydiphenlymethane, Benzene, 1-methoxy-3-(phenylmethyl)-, 1-Methoxy-3-benzylbenzene
| Molecular Formula | C14H14O |
|---|---|
| Molecular Weight | 198.10 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.10446 |
| Heavy Atoms | 15 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 23450-27-3 |
|---|---|
| SMILES | COC1=CC=CC(=C1)CC2=CC=CC=C2 |
| InChIKey | OJMXATJXHTWJDR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Benzyl-3-methoxybenzene (CAS 23450-27-3), with molecular formula C14H14O and molecular weight 198.10 g/mol. IUPAC: 1-benzyl-3-methoxybenzene.
Chemical Property Profile of 1-Benzyl-3-methoxybenzene
Property Insights of 1-Benzyl-3-methoxybenzene
The XLogP value of 4.2 indicates that 1-Benzyl-3-methoxybenzene 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-Benzyl-3-methoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-3-methoxybenzene 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-Benzyl-3-methoxybenzene?
The CAS number of 1-Benzyl-3-methoxybenzene is 23450-27-3.
What is the molecular formula of 1-Benzyl-3-methoxybenzene?
The molecular formula of 1-Benzyl-3-methoxybenzene is C14H14O.
What is the molecular weight of 1-Benzyl-3-methoxybenzene?
The molecular weight of 1-Benzyl-3-methoxybenzene is 198.10 g/mol.
Where can I buy 1-Benzyl-3-methoxybenzene?
You can request a quote for 1-Benzyl-3-methoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3-methoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3-methoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.