2-(Chloromethyl)-1,3,4,5-tetramethylbenzene
TL;DR: 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene (CAS 29328-87-8) is a chemical compound with molecular formula C11H15Cl and molecular weight 182.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(chloromethyl)-1,3,4,5-tetramethylbenzene
Also Known As: 2,3,4,6-tetramethyl-benzyl chloride, S-(4-Nitrobenzyl)-6-thioinosine, 2-(chloromethyl)-1,3,4,5-tetramethylbenzene, 2-(chloromethyl)-1,3,4,5-tetramethyl-benzene, 3-(Chloromethyl)-1,2,4,6-tetramethylbenzene
| Molecular Formula | C11H15Cl |
|---|---|
| Molecular Weight | 182.09 g/mol |
| LogP | 3.65908 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 182.08623 |
| Heavy Atoms | 12 |
| Complexity | 300.3627 |
Chemical Identifiers
| CAS Number | 29328-87-8 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1C)C)CCl)C |
Product Overview
2-(Chloromethyl)-1,3,4,5-tetramethylbenzene (CAS 29328-87-8), with molecular formula C11H15Cl and molecular weight 182.09 g/mol. IUPAC: 2-(chloromethyl)-1,3,4,5-tetramethylbenzene.
Chemical Property Profile of 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene
Property Insights of 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene
The XLogP value of 3.65908 indicates that 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene has 0 hydrogen bond donor(s) and 0 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 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene?
The CAS number of 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene is 29328-87-8.
What is the molecular formula of 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene?
The molecular formula of 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene is C11H15Cl.
What is the molecular weight of 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene?
The molecular weight of 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene is 182.09 g/mol.
Where can I buy 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene?
You can request a quote for 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 2-(Chloromethyl)-1,3,4,5-tetramethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.