2-Bromo-1-(4-(dimethylamino)phenyl)ethanone
TL;DR: 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone (CAS 37904-72-6) is a chemical compound with molecular formula C10H12BrNO and molecular weight 241.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-[4-(dimethylamino)phenyl]ethanone
Also Known As: 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone, 2-Bromo-1-[4-(dimethylamino)phenyl]ethanone, 2-bromo-1-(4-dimethylaminophenyl)ethanone, 2-bromo-1-(4-dimethylamino-phenyl)-ethanone, 4-(Dimethylamino)phenacyl bromide
| Molecular Formula | C10H12BrNO |
|---|---|
| Molecular Weight | 241.01 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.01022 |
| Heavy Atoms | 13 |
| Complexity | 174.0 |
Chemical Identifiers
| CAS Number | 37904-72-6 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)C(=O)CBr |
| InChIKey | YWNKTZFJKMGVRP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Bromo-1-(4-(dimethylamino)phenyl)ethanone (CAS 37904-72-6), with molecular formula C10H12BrNO and molecular weight 241.01 g/mol. IUPAC: 2-bromo-1-[4-(dimethylamino)phenyl]ethanone.
Chemical Property Profile of 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone
Property Insights of 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone. With a topological polar surface area (TPSA) of 20.3 Ų, 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone has 0 hydrogen bond donor(s) and 2 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-Bromo-1-(4-(dimethylamino)phenyl)ethanone?
The CAS number of 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone is 37904-72-6.
What is the molecular formula of 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone?
The molecular formula of 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone is C10H12BrNO.
What is the molecular weight of 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone?
The molecular weight of 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone is 241.01 g/mol.
Where can I buy 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone?
You can request a quote for 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-1-(4-(dimethylamino)phenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.