1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)
TL;DR: 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) (CAS 3043-04-7) is a chemical compound with molecular formula C22H28ClNO3 and molecular weight 389.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-ethylpyrrolidin-1-ium-3-yl) 2-ethoxy-2,2-diphenylacetate chloride
Also Known As: Acetic acid, 2,2-diphenyl-2-ethoxy-, (1-ethyl-3-pyrrolidinyl) ester, hydrochloride, 2,2-Diphenyl-2-ethoxyacetic acid (1-ethyl-3-pyrrolidinyl) ester hydrochloride, (1-ethylpyrrolidin-1-ium-3-yl) 2-ethoxy-2,2-diphenylacetate chloride, 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1), RefChem:1055470
| Molecular Formula | C22H28ClNO3 |
|---|---|
| Molecular Weight | 389.18 g/mol |
| LogP | -0.81 |
| Topological Polar Surface Area | 40.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 389.17578 |
| Heavy Atoms | 27 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 3043-04-7 |
|---|---|
| SMILES | CC[NH+]1CCC(C1)OC(=O)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCC.[Cl-] |
| InChIKey | KKQWBZPXBQQVBN-UHFFFAOYSA-N |
Product Overview
1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) (CAS 3043-04-7), with molecular formula C22H28ClNO3 and molecular weight 389.18 g/mol. IUPAC: (1-ethylpyrrolidin-1-ium-3-yl) 2-ethoxy-2,2-diphenylacetate chloride.
Chemical Property Profile of 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)
Property Insights of 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)
The XLogP value of -0.81 indicates that 1-Ethylpyrrolidin-3-yl 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, 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethylpyrrolidin-3-yl 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 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)?
The CAS number of 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) is 3043-04-7.
What is the molecular formula of 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)?
The molecular formula of 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) is C22H28ClNO3.
What is the molecular weight of 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)?
The molecular weight of 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) is 389.18 g/mol.
Where can I buy 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)?
You can request a quote for 1-Ethylpyrrolidin-3-yl 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 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethylpyrrolidin-3-yl ethoxy(diphenyl)acetate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.