Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1)
TL;DR: Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1) (CAS 73622-53-4) is a chemical compound with molecular formula C18H30ClNO2 and molecular weight 327.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibutyl-(2-ethoxy-2-oxo-1-phenylethyl)azanium chloride
Also Known As: 2-(Dibutylamino)-2-phenylacetic acid ethyl ester hydrochloride, dibutyl-(2-ethoxy-2-oxo-1-phenylethyl)azanium chloride, alpha-(Dibutylamino)-phenylessigsaeure-aethylester hydrochlorid, alpha-(Dibutylamino)-phenylessigsaeure-aethylester hydrochlorid [German], ACETIC ACID, 2-(DIBUTYLAMINO)-2-PHENYL-, ETHYL ESTER, HYDROCHLORIDE
| Molecular Formula | C18H30ClNO2 |
|---|---|
| Molecular Weight | 327.20 g/mol |
| LogP | -0.22 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 327.1965 |
| Heavy Atoms | 22 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 73622-53-4 |
|---|---|
| SMILES | CCCC[NH+](CCCC)C(C1=CC=CC=C1)C(=O)OCC.[Cl-] |
| InChIKey | GQOZYIPUAPWRQL-UHFFFAOYSA-N |
Product Overview
Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1) (CAS 73622-53-4), with molecular formula C18H30ClNO2 and molecular weight 327.20 g/mol. IUPAC: dibutyl-(2-ethoxy-2-oxo-1-phenylethyl)azanium chloride.
Chemical Property Profile of Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1)
Property Insights of Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1)
The XLogP value of -0.22 indicates that Ethyl (dibutylamino)(phenyl)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 30.7 Ų, Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1) 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 Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1)?
The CAS number of Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1) is 73622-53-4.
What is the molecular formula of Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1)?
The molecular formula of Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1) is C18H30ClNO2.
What is the molecular weight of Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1)?
The molecular weight of Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1) is 327.20 g/mol.
Where can I buy Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1)?
You can request a quote for Ethyl (dibutylamino)(phenyl)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 Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Ethyl (dibutylamino)(phenyl)acetate--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.