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Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester
TL;DR: Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester (CAS 30681-63-1) is a chemical compound with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2E)-2-(3-oxo-1,4-dihydroquinoxalin-2-ylidene)acetate
Also Known As: BAS 00392997, J2.480.881E, J3.455.202I, ethyl 2-(3-oxo-1,4-dihydroquinoxalin-2-ylidene)acetate, ethyl (2E)-2-(3-oxo-1,4-dihydroquinoxalin-2-ylidene)acetate
| Molecular Formula | C12H12N2O3 |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 1.4976 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.0848 |
| Heavy Atoms | 17 |
| Complexity | 494.27905 |
Chemical Identifiers
| CAS Number | 30681-63-1 |
|---|---|
| SMILES | CCOC(=O)/C=C/1\C(=O)NC2=CC=CC=C2N1 |
Product Overview
Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester (CAS 30681-63-1), with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol. IUPAC: ethyl (2E)-2-(3-oxo-1,4-dihydroquinoxalin-2-ylidene)acetate.
Chemical Property Profile of Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester
Property Insights of Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester
The XLogP value of 1.4976 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester. Following Lipinski's Rule of Five, Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester has 2 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 Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester?
The CAS number of Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester is 30681-63-1.
What is the molecular formula of Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester?
The molecular formula of Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester is C12H12N2O3.
What is the molecular weight of Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester?
The molecular weight of Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester is 232.08 g/mol.
Where can I buy Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester?
You can request a quote for Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, 2-[3,4-dihydro-3-oxo-2(1H)-quinoxalinyliden]-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.