4-Chloro-2-isopropyl-5-methylanisole
TL;DR: 4-Chloro-2-isopropyl-5-methylanisole (CAS 5903-07-1) is a chemical compound with molecular formula C11H15ClO and molecular weight 198.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-methoxy-2-methyl-5-propan-2-ylbenzene
Also Known As: Methyl chlorothymol, 4-Chloro-2-isopropyl-5-methylanisole, 4-chloro-2-isopropyl-5-methyl-anisole, 1-Chloro-5-isopropyl-4-methoxy-2-methylbenzene, 1-chloro-4-methoxy-2-methyl-5-propan-2-yl-benzene
| Molecular Formula | C11H15ClO |
|---|---|
| Molecular Weight | 198.08 g/mol |
| LogP | 3.78042 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.08115 |
| Heavy Atoms | 13 |
| Complexity | 305.20374 |
Chemical Identifiers
| CAS Number | 5903-07-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1Cl)C(C)C)OC |
Product Overview
4-Chloro-2-isopropyl-5-methylanisole (CAS 5903-07-1), with molecular formula C11H15ClO and molecular weight 198.08 g/mol. IUPAC: 1-chloro-4-methoxy-2-methyl-5-propan-2-ylbenzene.
Chemical Property Profile of 4-Chloro-2-isopropyl-5-methylanisole
Property Insights of 4-Chloro-2-isopropyl-5-methylanisole
The XLogP value of 3.78042 indicates that 4-Chloro-2-isopropyl-5-methylanisole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, 4-Chloro-2-isopropyl-5-methylanisole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-2-isopropyl-5-methylanisole 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 4-Chloro-2-isopropyl-5-methylanisole?
The CAS number of 4-Chloro-2-isopropyl-5-methylanisole is 5903-07-1.
What is the molecular formula of 4-Chloro-2-isopropyl-5-methylanisole?
The molecular formula of 4-Chloro-2-isopropyl-5-methylanisole is C11H15ClO.
What is the molecular weight of 4-Chloro-2-isopropyl-5-methylanisole?
The molecular weight of 4-Chloro-2-isopropyl-5-methylanisole is 198.08 g/mol.
Where can I buy 4-Chloro-2-isopropyl-5-methylanisole?
You can request a quote for 4-Chloro-2-isopropyl-5-methylanisole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-2-isopropyl-5-methylanisole?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-isopropyl-5-methylanisole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.