(1-(Dichloromethyl)-1-methylpropyl)benzene
TL;DR: (1-(Dichloromethyl)-1-methylpropyl)benzene (CAS 36318-77-1) is a chemical compound with molecular formula C11H14Cl2 and molecular weight 216.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,1-dichloro-2-methylbutan-2-yl)benzene
Also Known As: (1,1-dichloro-2-methylbutan-2-yl)benzene, 1,1-Dichloro-2-methyl-2-phenylbutane, [1-(Dichloromethyl)-1-methylpropyl]benzene, 1,1-Dichloro-2-methyl-2-phenylpropane, (1-(Dichloromethyl)-1-methylpropyl)benzene
| Molecular Formula | C11H14Cl2 |
|---|---|
| Molecular Weight | 216.05 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.04726 |
| Heavy Atoms | 13 |
| Complexity | 150.0 |
Chemical Identifiers
| CAS Number | 36318-77-1 |
|---|---|
| SMILES | CCC(C)(C1=CC=CC=C1)C(Cl)Cl |
| InChIKey | HZWWIJSYUMVUTJ-UHFFFAOYSA-N |
Product Overview
(1-(Dichloromethyl)-1-methylpropyl)benzene (CAS 36318-77-1), with molecular formula C11H14Cl2 and molecular weight 216.05 g/mol. IUPAC: (1,1-dichloro-2-methylbutan-2-yl)benzene.
Chemical Property Profile of (1-(Dichloromethyl)-1-methylpropyl)benzene
Property Insights of (1-(Dichloromethyl)-1-methylpropyl)benzene
The XLogP value of 4.8 indicates that (1-(Dichloromethyl)-1-methylpropyl)benzene 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-(Dichloromethyl)-1-methylpropyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-(Dichloromethyl)-1-methylpropyl)benzene 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 (1-(Dichloromethyl)-1-methylpropyl)benzene?
The CAS number of (1-(Dichloromethyl)-1-methylpropyl)benzene is 36318-77-1.
What is the molecular formula of (1-(Dichloromethyl)-1-methylpropyl)benzene?
The molecular formula of (1-(Dichloromethyl)-1-methylpropyl)benzene is C11H14Cl2.
What is the molecular weight of (1-(Dichloromethyl)-1-methylpropyl)benzene?
The molecular weight of (1-(Dichloromethyl)-1-methylpropyl)benzene is 216.05 g/mol.
Where can I buy (1-(Dichloromethyl)-1-methylpropyl)benzene?
You can request a quote for (1-(Dichloromethyl)-1-methylpropyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-(Dichloromethyl)-1-methylpropyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (1-(Dichloromethyl)-1-methylpropyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.