3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide
TL;DR: 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide (CAS 42477-08-7) is a chemical compound with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide
Also Known As: 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide, 3-chloro-N-2,3-dihydro-1,4-benzodioxin-6-ylpropanamide, 3-chloro-N-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)propanamide, 3-CHLORO-2,2-DIMETHYL-BUT-3-ENOICACIDMETHYLESTER, N-(2H,3H-benzo[3,4-e]1,4-dioxan-6-yl)-3-chloropropanamide
| Molecular Formula | C11H12ClNO3 |
|---|---|
| Molecular Weight | 241.05 g/mol |
| LogP | 2.0252 |
| Topological Polar Surface Area | 47.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.05057 |
| Heavy Atoms | 16 |
| Complexity | 394.8161 |
Chemical Identifiers
| CAS Number | 42477-08-7 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)CCCl |
Product Overview
3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide (CAS 42477-08-7), with molecular formula C11H12ClNO3 and molecular weight 241.05 g/mol. IUPAC: 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide.
Chemical Property Profile of 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide
Property Insights of 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide
The XLogP value of 2.0252 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide. With a topological polar surface area (TPSA) of 47.56 Ų, 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide 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 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide?
The CAS number of 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide is 42477-08-7.
What is the molecular formula of 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide?
The molecular formula of 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide is C11H12ClNO3.
What is the molecular weight of 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide?
The molecular weight of 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide is 241.05 g/mol.
Where can I buy 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide?
You can request a quote for 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.