1-Chloro-4-(2-methyl-2-propen-1-yl)benzene
TL;DR: 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene (CAS 23063-65-2) is a chemical compound with molecular formula C10H11Cl and molecular weight 166.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-(2-methylprop-2-enyl)benzene
Also Known As: 1-Chloro-4-(2-methylallyl)benzene, 2,2-Dimethyl-4-chlorostyrene, 3-(4-chlorophenyl)-2-methyl-1-propene, 4-Methallylchlorobenzene, p-Methallyl chlorobenzene
| Molecular Formula | C10H11Cl |
|---|---|
| Molecular Weight | 166.05 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.05493 |
| Heavy Atoms | 11 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 23063-65-2 |
|---|---|
| SMILES | CC(=C)CC1=CC=C(C=C1)Cl |
| InChIKey | VLIILLUQCKLPLB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Chloro-4-(2-methyl-2-propen-1-yl)benzene (CAS 23063-65-2), with molecular formula C10H11Cl and molecular weight 166.05 g/mol. IUPAC: 1-chloro-4-(2-methylprop-2-enyl)benzene.
Chemical Property Profile of 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene
Property Insights of 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene
The XLogP value of 4.2 indicates that 1-Chloro-4-(2-methyl-2-propen-1-yl)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-Chloro-4-(2-methyl-2-propen-1-yl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-4-(2-methyl-2-propen-1-yl)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-Chloro-4-(2-methyl-2-propen-1-yl)benzene?
The CAS number of 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene is 23063-65-2.
What is the molecular formula of 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene?
The molecular formula of 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene is C10H11Cl.
What is the molecular weight of 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene?
The molecular weight of 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene is 166.05 g/mol.
Where can I buy 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene?
You can request a quote for 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-4-(2-methyl-2-propen-1-yl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.