4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide
TL;DR: 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide (CAS 53183-90-7) is a chemical compound with molecular formula C10H13NO8 and molecular weight 275.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4-(2-methoxy-2-oxoethyl)-2-oxido-4,5-dihydro-1,2-oxazol-2-ium-3,5-dicarboxylate
Also Known As: 4-(2-methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide, dimethyl 4-(2-methoxy-2-oxoethyl)-2-oxido-4,5-dihydro-1,2-oxazol-2-ium-3,5-dicarboxylate, dimethyl 4-(2-methoxy-2-oxoethyl)-4,5-dihydro-1,2-oxazole-3,5-dicarboxylate 2-oxide, Dimethyl 4-(2-methoxy-2-oxoethyl)-4,5-dihydro-3,5-isoxazoledicarboxylate 2-oxide
| Molecular Formula | C10H13NO8 |
|---|---|
| Molecular Weight | 275.06 g/mol |
| LogP | -1.2232 |
| Topological Polar Surface Area | 114.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.06412 |
| Heavy Atoms | 19 |
| Complexity | 429.24557 |
Chemical Identifiers
| CAS Number | 53183-90-7 |
|---|---|
| SMILES | COC(=O)CC1C(O[N+](=C1C(=O)OC)[O-])C(=O)OC |
Product Overview
4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide (CAS 53183-90-7), with molecular formula C10H13NO8 and molecular weight 275.06 g/mol. IUPAC: dimethyl 4-(2-methoxy-2-oxoethyl)-2-oxido-4,5-dihydro-1,2-oxazol-2-ium-3,5-dicarboxylate.
Chemical Property Profile of 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide
Property Insights of 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide
The XLogP value of -1.2232 indicates that 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 114.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide. Following Lipinski's Rule of Five, 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide has 0 hydrogen bond donor(s) and 8 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 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide?
The CAS number of 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide is 53183-90-7.
What is the molecular formula of 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide?
The molecular formula of 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide is C10H13NO8.
What is the molecular weight of 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide?
The molecular weight of 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide is 275.06 g/mol.
Where can I buy 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide?
You can request a quote for 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Methoxy-2-oxoethyl)-3,5-bis(methoxycarbonyl)-4,5-dihydroisoxazole 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.