1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride
TL;DR: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride (CAS 838-49-3) is a chemical compound with molecular formula C13H18ClNO3 and molecular weight 271.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one;hydrochloride
Also Known As: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride, 1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-3-(dimethylamino) propan-1-one hydrochloride, 1-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride, 3-dimethylamino-1-(7,10-dioxabicyclo[4.4.0]deca-2,4,11-trien-3-yl)propan-1-one Hydrochloride
| Molecular Formula | C13H18ClNO3 |
|---|---|
| Molecular Weight | 271.10 g/mol |
| LogP | 2.014 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 271.09753 |
| Heavy Atoms | 18 |
| Complexity | 420.69742 |
Chemical Identifiers
| CAS Number | 838-49-3 |
|---|---|
| SMILES | CN(C)CCC(=O)C1=CC2=C(C=C1)OCCO2.Cl |
Product Overview
1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride (CAS 838-49-3), with molecular formula C13H18ClNO3 and molecular weight 271.10 g/mol. IUPAC: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one;hydrochloride.
Chemical Property Profile of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride
Property Insights of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride
The XLogP value of 2.014 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride. With a topological polar surface area (TPSA) of 38.77 Ų, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride has 0 hydrogen bond donor(s) and 4 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-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride?
The CAS number of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride is 838-49-3.
What is the molecular formula of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride?
The molecular formula of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride is C13H18ClNO3.
What is the molecular weight of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride?
The molecular weight of 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride is 271.10 g/mol.
Where can I buy 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride?
You can request a quote for 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(dimethylamino)propan-1-one hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.