2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide
TL;DR: 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide (CAS 733762-53-3) is a chemical compound with molecular formula C9H6ClF2NO3 and molecular weight 249.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide
Also Known As: 2-chloro-N-(2,2-difluoro-2H-1,3-benzodioxol-5-yl)acetamide, 2-Chloro-N-(2,2-difluoro-benzo[1,3]dioxol-5-yl)-acetamide, 2-chloro-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide, 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide, 989-494-5
| Molecular Formula | C9H6ClF2NO3 |
|---|---|
| Molecular Weight | 249.00 g/mol |
| LogP | 2.1854 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.00043 |
| Heavy Atoms | 16 |
| Complexity | 438.76233 |
Chemical Identifiers
| CAS Number | 733762-53-3 |
|---|---|
| SMILES | C1=CC2=C(C=C1NC(=O)CCl)OC(O2)(F)F |
Product Overview
2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide (CAS 733762-53-3), with molecular formula C9H6ClF2NO3 and molecular weight 249.00 g/mol. IUPAC: 2-chloro-N-(2,2-difluoro-1,3-benzodioxol-5-yl)acetamide.
Chemical Property Profile of 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide
Property Insights of 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide
The XLogP value of 2.1854 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide. With a topological polar surface area (TPSA) of 47.56 Ų, 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide has 1 hydrogen bond donor(s) and 3 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-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide?
The CAS number of 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide is 733762-53-3.
What is the molecular formula of 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide?
The molecular formula of 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide is C9H6ClF2NO3.
What is the molecular weight of 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide?
The molecular weight of 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide is 249.00 g/mol.
Where can I buy 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide?
You can request a quote for 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(2,2-difluoro-1,3-dioxaindan-5-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.