trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride
TL;DR: trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride (CAS 73791-03-4) is a chemical compound with molecular formula C19H21ClN2O4 and molecular weight 376.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-[2-[(E)-3-(4-nitrophenyl)-2-phenylprop-2-enoyl]oxyethyl]azanium chloride
Also Known As: trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride, Cinnamic acid, 4-nitro-alpha-phenyl-, 2-(dimethylamino)ethyl ester, hydrochloride, E-, Benzeneacetic acid, alpha-((4-nitrophenyl)methylene)-, 2-(dimethylamino)ethyl ester, HCl, (E)-, dimethyl-[2-[(E)-3-(4-nitrophenyl)-2-phenylprop-2-enoyl]oxyethyl]azanium chloride, Benzeneacetic acid, .alpha.-[(4-nitrophenyl)methylene]-, 2-(dimethylamino)ethyl ester, monohydrochloride, (E)-
| Molecular Formula | C19H21ClN2O4 |
|---|---|
| Molecular Weight | 376.12 g/mol |
| LogP | -1.1729 |
| Topological Polar Surface Area | 73.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 376.119 |
| Heavy Atoms | 26 |
| Complexity | 758.8684 |
Chemical Identifiers
| CAS Number | 73791-03-4 |
|---|---|
| SMILES | C[NH+](C)CCOC(=O)/C(=C/C1=CC=C(C=C1)[N+](=O)[O-])/C2=CC=CC=C2.[Cl-] |
Product Overview
trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride (CAS 73791-03-4), with molecular formula C19H21ClN2O4 and molecular weight 376.12 g/mol. IUPAC: dimethyl-[2-[(E)-3-(4-nitrophenyl)-2-phenylprop-2-enoyl]oxyethyl]azanium chloride.
Chemical Property Profile of trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride
Property Insights of trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride
The XLogP value of -1.1729 indicates that trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 73.88 Ų falls within the moderate polarity range, balancing permeability and solubility for trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride. Following Lipinski's Rule of Five, trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride 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 trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride?
The CAS number of trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride is 73791-03-4.
What is the molecular formula of trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride?
The molecular formula of trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride is C19H21ClN2O4.
What is the molecular weight of trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride?
The molecular weight of trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride is 376.12 g/mol.
Where can I buy trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride?
You can request a quote for trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)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 trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for trans-4-Nitro-alpha-phenylcinnamic acid 2-(dimethylamino)ethyl ester hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.