1-(2,2-Dimethylpropoxy)-3-phenoxybenzene
TL;DR: 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene (CAS 98992-43-9) is a chemical compound with molecular formula C17H20O2 and molecular weight 256.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,2-dimethylpropoxy)-3-phenoxybenzene
Also Known As: 1-(2,2-dimethylpropoxy)-3-phenoxybenzene, 1-(2,2-dimethylpropoxy)-3-phenoxy-benzene
| Molecular Formula | C17H20O2 |
|---|---|
| Molecular Weight | 256.15 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 256.14633 |
| Heavy Atoms | 19 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 98992-43-9 |
|---|---|
| SMILES | CC(C)(C)COC1=CC(=CC=C1)OC2=CC=CC=C2 |
| InChIKey | NCFAHLHFNAFNPJ-UHFFFAOYSA-N |
Product Overview
1-(2,2-Dimethylpropoxy)-3-phenoxybenzene (CAS 98992-43-9), with molecular formula C17H20O2 and molecular weight 256.15 g/mol. IUPAC: 1-(2,2-dimethylpropoxy)-3-phenoxybenzene.
Chemical Property Profile of 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene
Property Insights of 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene
The XLogP value of 5.1 indicates that 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene?
The CAS number of 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene is 98992-43-9.
What is the molecular formula of 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene?
The molecular formula of 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene is C17H20O2.
What is the molecular weight of 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene?
The molecular weight of 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene is 256.15 g/mol.
Where can I buy 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene?
You can request a quote for 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,2-Dimethylpropoxy)-3-phenoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.