1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene
TL;DR: 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene (CAS 133220-70-9) is a chemical compound with molecular formula C9H8Cl2 and molecular weight 186.0003 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-3-(3-chloroprop-1-en-2-yl)benzene
Also Known As: 1-chloro-3-(3-chloroprop-1-en-2-yl)benzene, 3-Chloro-alpha-(chloromethyl)styrene, 3-chloro-alpha-(chloromethyl)-styrene, 1-[1-(Chloromethyl)vinyl]-3-chlorobenzene, Benzene, 1-chloro-3-[1-(chloromethyl)ethenyl]-
Technical Specifications
| Molecular Formula | C9H8Cl2 |
| Molecular Weight | 186.0003 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.0003 Da |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
| SMILES | C=C(CCl)C1=CC(=CC=C1)Cl |
| InChIKey | UZYYNLUVALVDOZ-UHFFFAOYSA-N |
Chemical Property Profile of 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene
Property Insights of 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene
The XLogP value of 4.0 indicates that 1-Chloro-3-(3-chloroprop-1-en-2-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-3-(3-chloroprop-1-en-2-yl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-3-(3-chloroprop-1-en-2-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
What is the CAS number of 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene?
The CAS number of 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene is 133220-70-9.
What is the molecular formula of 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene?
The molecular formula of 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene is C9H8Cl2.
What is the molecular weight of 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene?
The molecular weight of 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene is 186.0003 g/mol.
Where can I buy 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene?
You can request a quote for 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene?
Yes, CoreyChem provides custom synthesis services for 1-Chloro-3-(3-chloroprop-1-en-2-yl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.