((2-Chloro-2-propenyl)oxy)benzene
TL;DR: ((2-Chloro-2-propenyl)oxy)benzene (CAS 53299-53-9) is a chemical compound with molecular formula C9H9ClO and molecular weight 168.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroprop-2-enoxybenzene
Also Known As: 2-chloroprop-2-enoxybenzene, ((2-chloroallyl)oxy)benzene, [(2-Chloro-2-propenyl)oxy]benzene, ((2-CHLORO-2-PROPENYL)OXY)BENZENE, (2-chloro-allyl)-phenyl ether
| Molecular Formula | C9H9ClO |
|---|---|
| Molecular Weight | 168.03 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 168.0342 |
| Heavy Atoms | 11 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 53299-53-9 |
|---|---|
| SMILES | C=C(COC1=CC=CC=C1)Cl |
| InChIKey | AJVWOOHXLSXQSU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
((2-Chloro-2-propenyl)oxy)benzene (CAS 53299-53-9), with molecular formula C9H9ClO and molecular weight 168.03 g/mol. IUPAC: 2-chloroprop-2-enoxybenzene.
Chemical Property Profile of ((2-Chloro-2-propenyl)oxy)benzene
Property Insights of ((2-Chloro-2-propenyl)oxy)benzene
The XLogP value of 3.0 indicates that ((2-Chloro-2-propenyl)oxy)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, ((2-Chloro-2-propenyl)oxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ((2-Chloro-2-propenyl)oxy)benzene has 0 hydrogen bond donor(s) and 1 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 ((2-Chloro-2-propenyl)oxy)benzene?
The CAS number of ((2-Chloro-2-propenyl)oxy)benzene is 53299-53-9.
What is the molecular formula of ((2-Chloro-2-propenyl)oxy)benzene?
The molecular formula of ((2-Chloro-2-propenyl)oxy)benzene is C9H9ClO.
What is the molecular weight of ((2-Chloro-2-propenyl)oxy)benzene?
The molecular weight of ((2-Chloro-2-propenyl)oxy)benzene is 168.03 g/mol.
Where can I buy ((2-Chloro-2-propenyl)oxy)benzene?
You can request a quote for ((2-Chloro-2-propenyl)oxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ((2-Chloro-2-propenyl)oxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for ((2-Chloro-2-propenyl)oxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.