1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone
TL;DR: 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone (CAS 338392-04-4) is a chemical compound with molecular formula C11H12BrNO and molecular weight 253.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-bromophenyl)-3,3-dimethylazetidin-2-one
Also Known As: 1-(3-bromophenyl)-3,3-dimethyl-2-azetanone, 1-(3-bromophenyl)-3,3-dimethylazetidin-2-one, bromophenyldimethylazetanone, J3.501.272I, 1-(3-bromophenyl)-3,3-dimethyl-azetidin-2-one
| Molecular Formula | C11H12BrNO |
|---|---|
| Molecular Weight | 253.01 g/mol |
| LogP | 2.8219 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.01022 |
| Heavy Atoms | 14 |
| Complexity | 386.62885 |
Chemical Identifiers
| CAS Number | 338392-04-4 |
|---|---|
| SMILES | CC1(CN(C1=O)C2=CC(=CC=C2)Br)C |
Product Overview
1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone (CAS 338392-04-4), with molecular formula C11H12BrNO and molecular weight 253.01 g/mol. IUPAC: 1-(3-bromophenyl)-3,3-dimethylazetidin-2-one.
Chemical Property Profile of 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone
Property Insights of 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone
The XLogP value of 2.8219 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone. With a topological polar surface area (TPSA) of 20.31 Ų, 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone 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-(3-Bromophenyl)-3,3-dimethyl-2-azetanone?
The CAS number of 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone is 338392-04-4.
What is the molecular formula of 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone?
The molecular formula of 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone is C11H12BrNO.
What is the molecular weight of 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone?
The molecular weight of 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone is 253.01 g/mol.
Where can I buy 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone?
You can request a quote for 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Bromophenyl)-3,3-dimethyl-2-azetanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.