2-Chloro-1-(4-Isopropylphenyl)Ethanone
TL;DR: 2-Chloro-1-(4-Isopropylphenyl)Ethanone (CAS 21886-60-2) is a chemical compound with molecular formula C11H13ClO and molecular weight 196.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1-(4-propan-2-ylphenyl)ethanone
Also Known As: 2-chloro-1-(4-isopropylphenyl)ethanone, 2-chloro-4-isopropylacetophenone, 4-isopropylphenacyl chloride, 2-chloro-1-[4-(propan-2-yl)phenyl]ethan-1-one, Ethanone,2-chloro-1-[4-(1-methylethyl)phenyl]-
| Molecular Formula | C11H13ClO |
|---|---|
| Molecular Weight | 196.07 g/mol |
| LogP | 3.2315 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.06549 |
| Heavy Atoms | 13 |
| Complexity | 287.46353 |
Chemical Identifiers
| CAS Number | 21886-60-2 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C(=O)CCl |
Product Overview
2-Chloro-1-(4-Isopropylphenyl)Ethanone (CAS 21886-60-2), with molecular formula C11H13ClO and molecular weight 196.07 g/mol. IUPAC: 2-chloro-1-(4-propan-2-ylphenyl)ethanone.
Chemical Property Profile of 2-Chloro-1-(4-Isopropylphenyl)Ethanone
Property Insights of 2-Chloro-1-(4-Isopropylphenyl)Ethanone
The XLogP value of 3.2315 indicates that 2-Chloro-1-(4-Isopropylphenyl)Ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Chloro-1-(4-Isopropylphenyl)Ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-1-(4-Isopropylphenyl)Ethanone 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-1-(4-Isopropylphenyl)Ethanone?
The CAS number of 2-Chloro-1-(4-Isopropylphenyl)Ethanone is 21886-60-2.
What is the molecular formula of 2-Chloro-1-(4-Isopropylphenyl)Ethanone?
The molecular formula of 2-Chloro-1-(4-Isopropylphenyl)Ethanone is C11H13ClO.
What is the molecular weight of 2-Chloro-1-(4-Isopropylphenyl)Ethanone?
The molecular weight of 2-Chloro-1-(4-Isopropylphenyl)Ethanone is 196.07 g/mol.
Where can I buy 2-Chloro-1-(4-Isopropylphenyl)Ethanone?
You can request a quote for 2-Chloro-1-(4-Isopropylphenyl)Ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-1-(4-Isopropylphenyl)Ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-1-(4-Isopropylphenyl)Ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.