3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride
TL;DR: 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride (CAS 1052419-23-4) is a chemical compound with molecular formula C14H20ClNO4 and molecular weight 301.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate;hydrochloride
Also Known As: 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride, 3-(dimethylamino)propyl 2,3-dihydrobenzo[b][1,4]dioxine-6-carboxylate hydrochloride, 3-dimethylaminopropyl 7,10-dioxabicyclo[4.4.0]deca-2,4,11-triene-3-carboxylate Hydrochloride
| Molecular Formula | C14H20ClNO4 |
|---|---|
| Molecular Weight | 301.11 g/mol |
| LogP | 1.9881 |
| Topological Polar Surface Area | 48.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.1081 |
| Heavy Atoms | 20 |
| Complexity | 450.80008 |
Chemical Identifiers
| CAS Number | 1052419-23-4 |
|---|---|
| SMILES | CN(C)CCCOC(=O)C1=CC2=C(C=C1)OCCO2.Cl |
Product Overview
3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride (CAS 1052419-23-4), with molecular formula C14H20ClNO4 and molecular weight 301.11 g/mol. IUPAC: 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate;hydrochloride.
Chemical Property Profile of 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride
Property Insights of 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride
The XLogP value of 1.9881 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride. With a topological polar surface area (TPSA) of 48.0 Ų, 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride has 0 hydrogen bond donor(s) and 5 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-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride?
The CAS number of 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride is 1052419-23-4.
What is the molecular formula of 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride?
The molecular formula of 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride is C14H20ClNO4.
What is the molecular weight of 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride?
The molecular weight of 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride is 301.11 g/mol.
Where can I buy 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride?
You can request a quote for 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-(dimethylamino)propyl 2,3-dihydro-1,4-benzodioxine-6-carboxylate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.