2'-Bromoacetanilide
TL;DR: 2'-Bromoacetanilide (CAS 614-76-6) is a chemical compound with molecular formula CC(=O)NC1=CC=CC=C1Br and molecular weight 212.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromophenyl)acetamide
Also Known As: 2'-Bromoacetanilide, N-(2-Bromophenyl)acetamide, 2-bromoacetanilide, o-Bromoacetanilide, o-bromo acetanilide
| Molecular Formula | CC(=O)NC1=CC=CC=C1Br |
|---|---|
| Molecular Weight | 212.98 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.97893 |
| Heavy Atoms | 11 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 614-76-6 |
|---|---|
| SMILES | CC(=O)NC1=CC=CC=C1Br |
| InChIKey | VOBKUOHHOWQHFZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2'-Bromoacetanilide (CAS 614-76-6), with molecular formula CC(=O)NC1=CC=CC=C1Br and molecular weight 212.98 g/mol. IUPAC: N-(2-bromophenyl)acetamide.
Chemical Property Profile of 2'-Bromoacetanilide
Property Insights of 2'-Bromoacetanilide
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2'-Bromoacetanilide. With a topological polar surface area (TPSA) of 29.1 Ų, 2'-Bromoacetanilide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2'-Bromoacetanilide has 1 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'-Bromoacetanilide?
The CAS number of 2'-Bromoacetanilide is 614-76-6.
What is the molecular formula of 2'-Bromoacetanilide?
The molecular formula of 2'-Bromoacetanilide is CC(=O)NC1=CC=CC=C1Br.
What is the molecular weight of 2'-Bromoacetanilide?
The molecular weight of 2'-Bromoacetanilide is 212.98 g/mol.
Where can I buy 2'-Bromoacetanilide?
You can request a quote for 2'-Bromoacetanilide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-Bromoacetanilide?
Yes, KEHONG BIO provides custom synthesis services for 2'-Bromoacetanilide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.