1-Phenyl-2-chloro-2-methylpropane
TL;DR: 1-Phenyl-2-chloro-2-methylpropane (CAS 1754-74-1) is a chemical compound with molecular formula C10H13Cl and molecular weight 168.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-2-methylpropyl)benzene
Also Known As: (2-chloro-2-methylpropyl)benzene, 1-phenyl-2-chloro-2-methylpropane, 2-Chloro-2-methylpropylbenzene, (2-chloro-2-methyl-propyl)benzene, Benzene, (2-chloro-2-methylpropyl)-
| Molecular Formula | C10H13Cl |
|---|---|
| Molecular Weight | 168.07 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.07057 |
| Heavy Atoms | 11 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 1754-74-1 |
|---|---|
| SMILES | CC(C)(CC1=CC=CC=C1)Cl |
| InChIKey | YMKBSXVBAHEQHF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Phenyl-2-chloro-2-methylpropane (CAS 1754-74-1), with molecular formula C10H13Cl and molecular weight 168.07 g/mol. IUPAC: (2-chloro-2-methylpropyl)benzene.
Chemical Property Profile of 1-Phenyl-2-chloro-2-methylpropane
Property Insights of 1-Phenyl-2-chloro-2-methylpropane
The XLogP value of 3.4 indicates that 1-Phenyl-2-chloro-2-methylpropane 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-Phenyl-2-chloro-2-methylpropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-2-chloro-2-methylpropane 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-Phenyl-2-chloro-2-methylpropane?
The CAS number of 1-Phenyl-2-chloro-2-methylpropane is 1754-74-1.
What is the molecular formula of 1-Phenyl-2-chloro-2-methylpropane?
The molecular formula of 1-Phenyl-2-chloro-2-methylpropane is C10H13Cl.
What is the molecular weight of 1-Phenyl-2-chloro-2-methylpropane?
The molecular weight of 1-Phenyl-2-chloro-2-methylpropane is 168.07 g/mol.
Where can I buy 1-Phenyl-2-chloro-2-methylpropane?
You can request a quote for 1-Phenyl-2-chloro-2-methylpropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-2-chloro-2-methylpropane?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-2-chloro-2-methylpropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.