p-ethoxyneophyl chloride
TL;DR: p-ethoxyneophyl chloride (CAS 83493-80-5) is a chemical compound with molecular formula C12H17ClO and molecular weight 212.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-chloro-2-methylpropan-2-yl)-4-ethoxybenzene
Also Known As: p-ethoxyneophyl chloride, 1-(1-chloro-2-methylpropan-2-yl)-4-ethoxybenzene, 1-(2-chloro-tert-butyl)-4-ethoxybenzene, Benzene, 1-(2-chloro-1,1-dimethylethyl)-4-ethoxy-, RefChem:379945
| Molecular Formula | C12H17ClO |
|---|---|
| Molecular Weight | 212.10 g/mol |
| LogP | 3.6017 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.09679 |
| Heavy Atoms | 14 |
| Complexity | 276.87814 |
Chemical Identifiers
| CAS Number | 83493-80-5 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(C)(C)CCl |
Product Overview
p-ethoxyneophyl chloride (CAS 83493-80-5), with molecular formula C12H17ClO and molecular weight 212.10 g/mol. IUPAC: 1-(1-chloro-2-methylpropan-2-yl)-4-ethoxybenzene.
Chemical Property Profile of p-ethoxyneophyl chloride
Property Insights of p-ethoxyneophyl chloride
The XLogP value of 3.6017 indicates that p-ethoxyneophyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, p-ethoxyneophyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-ethoxyneophyl chloride 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 p-ethoxyneophyl chloride?
The CAS number of p-ethoxyneophyl chloride is 83493-80-5.
What is the molecular formula of p-ethoxyneophyl chloride?
The molecular formula of p-ethoxyneophyl chloride is C12H17ClO.
What is the molecular weight of p-ethoxyneophyl chloride?
The molecular weight of p-ethoxyneophyl chloride is 212.10 g/mol.
Where can I buy p-ethoxyneophyl chloride?
You can request a quote for p-ethoxyneophyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-ethoxyneophyl chloride?
Yes, KEHONG BIO provides custom synthesis services for p-ethoxyneophyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.