Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride
TL;DR: Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride (CAS 63992-55-2) is a chemical compound with molecular formula C22H28ClNO2 and molecular weight 373.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(E)-4,4-diphenylbut-2-enoyl]oxyethyl-diethylazanium chloride
Also Known As: 4,4-Diphenylcrotonic acid 2-(diethylamino)ethyl ester hydrochloride, CROTONIC ACID, 4,4-DIPHENYL-, 2-(DIETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE, 2-(Diethylamino)ethyl ester of 4,4-diphenylcrotonic acid hydrochloride, 2-[(E)-4,4-diphenylbut-2-enoyl]oxyethyl-diethylazanium chloride, 2-Butenoic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride
| Molecular Formula | C22H28ClNO2 |
|---|---|
| Molecular Weight | 373.18 g/mol |
| LogP | -0.1534 |
| Topological Polar Surface Area | 30.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 373.18085 |
| Heavy Atoms | 26 |
| Complexity | 614.8572 |
Chemical Identifiers
| CAS Number | 63992-55-2 |
|---|---|
| SMILES | CC[NH+](CC)CCOC(=O)/C=C/C(C1=CC=CC=C1)C2=CC=CC=C2.[Cl-] |
Product Overview
Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride (CAS 63992-55-2), with molecular formula C22H28ClNO2 and molecular weight 373.18 g/mol. IUPAC: 2-[(E)-4,4-diphenylbut-2-enoyl]oxyethyl-diethylazanium chloride.
Chemical Property Profile of Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride
Property Insights of Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride
The XLogP value of -0.1534 indicates that Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 30.74 Ų, Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride has 1 hydrogen bond donor(s) and 2 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 Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride?
The CAS number of Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride is 63992-55-2.
What is the molecular formula of Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride?
The molecular formula of Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride is C22H28ClNO2.
What is the molecular weight of Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride?
The molecular weight of Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride is 373.18 g/mol.
Where can I buy Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride?
You can request a quote for Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Crotonic acid, 4,4-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.