1-Propanone, 1-(3-chlorophenyl)-2-methyl-
TL;DR: 1-Propanone, 1-(3-chlorophenyl)-2-methyl- (CAS 55649-98-4) is a chemical compound with molecular formula C10H11ClO and molecular weight 182.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-chlorophenyl)-2-methylpropan-1-one
Also Known As: 1-(3-chlorophenyl)-2-methylpropan-1-one, 3-Chlorophenylisopropyl ketone, 3'-Chloro-2-methylpropiophenone, m-chlorophenyl isopropyl ketone, Isopropyl 3-chlorophenyl ketone
| Molecular Formula | C10H11ClO |
|---|---|
| Molecular Weight | 182.05 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.04984 |
| Heavy Atoms | 12 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 55649-98-4 |
|---|---|
| SMILES | CC(C)C(=O)C1=CC(=CC=C1)Cl |
| InChIKey | UVZXOZZFQHKFDK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Propanone, 1-(3-chlorophenyl)-2-methyl- (CAS 55649-98-4), with molecular formula C10H11ClO and molecular weight 182.05 g/mol. IUPAC: 1-(3-chlorophenyl)-2-methylpropan-1-one.
Chemical Property Profile of 1-Propanone, 1-(3-chlorophenyl)-2-methyl-
Property Insights of 1-Propanone, 1-(3-chlorophenyl)-2-methyl-
The XLogP value of 3.6 indicates that 1-Propanone, 1-(3-chlorophenyl)-2-methyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1-Propanone, 1-(3-chlorophenyl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propanone, 1-(3-chlorophenyl)-2-methyl- 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 1-Propanone, 1-(3-chlorophenyl)-2-methyl-?
The CAS number of 1-Propanone, 1-(3-chlorophenyl)-2-methyl- is 55649-98-4.
What is the molecular formula of 1-Propanone, 1-(3-chlorophenyl)-2-methyl-?
The molecular formula of 1-Propanone, 1-(3-chlorophenyl)-2-methyl- is C10H11ClO.
What is the molecular weight of 1-Propanone, 1-(3-chlorophenyl)-2-methyl-?
The molecular weight of 1-Propanone, 1-(3-chlorophenyl)-2-methyl- is 182.05 g/mol.
Where can I buy 1-Propanone, 1-(3-chlorophenyl)-2-methyl-?
You can request a quote for 1-Propanone, 1-(3-chlorophenyl)-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanone, 1-(3-chlorophenyl)-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanone, 1-(3-chlorophenyl)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.