3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)
TL;DR: 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) (CAS 2893-71-2) is a chemical compound with molecular formula C22H30ClNO3 and molecular weight 391.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-ethoxy-2,2-diphenylacetyl)oxybutan-2-yl-dimethylazanium chloride
Also Known As: 2,2-Diphenyl-2-ethoxyacetic acid 3-(dimethylamino)butyl ester hydrochloride, 4-(2-ethoxy-2,2-diphenylacetyl)oxybutan-2-yl-dimethylazanium chloride, ACETIC ACID, 2,2-DIPHENYL-2-ETHOXY-, 3-(DIMETHYLAMINO)BUTYL ESTER, HYDROCHLORIDE, 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1), Acetic acid, ethoxydiphenyl-, 3-(dimethylamino)butyl ester, hydrochloride
| Molecular Formula | C22H30ClNO3 |
|---|---|
| Molecular Weight | 391.19 g/mol |
| LogP | -0.56 |
| Topological Polar Surface Area | 40.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 391.1914 |
| Heavy Atoms | 27 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 2893-71-2 |
|---|---|
| SMILES | CCOC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)OCCC(C)[NH+](C)C.[Cl-] |
| InChIKey | CNOKWLFQDCNVPW-UHFFFAOYSA-N |
Product Overview
3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) (CAS 2893-71-2), with molecular formula C22H30ClNO3 and molecular weight 391.19 g/mol. IUPAC: 4-(2-ethoxy-2,2-diphenylacetyl)oxybutan-2-yl-dimethylazanium chloride.
Chemical Property Profile of 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)
Property Insights of 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)
The XLogP value of -0.56 indicates that 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.0 Ų, 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) has 1 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 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)?
The CAS number of 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) is 2893-71-2.
What is the molecular formula of 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)?
The molecular formula of 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) is C22H30ClNO3.
What is the molecular weight of 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)?
The molecular weight of 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) is 391.19 g/mol.
Where can I buy 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)?
You can request a quote for 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 3-(Dimethylamino)butyl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.