1-Chloro-3,5-diisopropyl-4-methylbenzene
TL;DR: 1-Chloro-3,5-diisopropyl-4-methylbenzene (CAS 98184-17-9) is a chemical compound with molecular formula C13H19Cl and molecular weight 210.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-methyl-1,3-di(propan-2-yl)benzene
Also Known As: 1-Chloro-3,5-diisopropyl-4-methylbenzene, 5-chloro-2-methyl-1,3-di(propan-2-yl)benzene, 5-CHLORO-2-METHYL-1,3-DIPROPAN-2-YL-BENZENE
| Molecular Formula | C13H19Cl |
|---|---|
| Molecular Weight | 210.12 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.11752 |
| Heavy Atoms | 14 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 98184-17-9 |
|---|---|
| SMILES | CC1=C(C=C(C=C1C(C)C)Cl)C(C)C |
| InChIKey | UHDIGKFOULRONL-UHFFFAOYSA-N |
Product Overview
1-Chloro-3,5-diisopropyl-4-methylbenzene (CAS 98184-17-9), with molecular formula C13H19Cl and molecular weight 210.12 g/mol. IUPAC: 5-chloro-2-methyl-1,3-di(propan-2-yl)benzene.
Chemical Property Profile of 1-Chloro-3,5-diisopropyl-4-methylbenzene
Property Insights of 1-Chloro-3,5-diisopropyl-4-methylbenzene
The XLogP value of 5.2 indicates that 1-Chloro-3,5-diisopropyl-4-methylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Chloro-3,5-diisopropyl-4-methylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-3,5-diisopropyl-4-methylbenzene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Chloro-3,5-diisopropyl-4-methylbenzene?
The CAS number of 1-Chloro-3,5-diisopropyl-4-methylbenzene is 98184-17-9.
What is the molecular formula of 1-Chloro-3,5-diisopropyl-4-methylbenzene?
The molecular formula of 1-Chloro-3,5-diisopropyl-4-methylbenzene is C13H19Cl.
What is the molecular weight of 1-Chloro-3,5-diisopropyl-4-methylbenzene?
The molecular weight of 1-Chloro-3,5-diisopropyl-4-methylbenzene is 210.12 g/mol.
Where can I buy 1-Chloro-3,5-diisopropyl-4-methylbenzene?
You can request a quote for 1-Chloro-3,5-diisopropyl-4-methylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-3,5-diisopropyl-4-methylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-3,5-diisopropyl-4-methylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.