![Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester structure](/static/products/1610/161083-22-3.webp)
Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester
TL;DR: Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester (CAS 161083-22-3) is a chemical compound with molecular formula C7H8F3NO4 and molecular weight 227.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-ethoxycarbonylimino-3,3,3-trifluoropropanoate
Also Known As: methyl 2-ethoxycarbonylimino-3,3,3-trifluoropropanoate, Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester, METHYL 2-[(ETHOXYCARBONYL)IMINO]-3,3,3-TRIFLUOROPROPANOATE, Methyl 2-((ethoxycarbonyl)imino)-3,3,3-trifluoropropanoate
| Molecular Formula | C7H8F3NO4 |
|---|---|
| Molecular Weight | 227.04 g/mol |
| LogP | 1.3192 |
| Topological Polar Surface Area | 64.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.04054 |
| Heavy Atoms | 15 |
| Complexity | 284.4501 |
Chemical Identifiers
| CAS Number | 161083-22-3 |
|---|---|
| SMILES | CCOC(=O)N=C(C(=O)OC)C(F)(F)F |
Product Overview
Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester (CAS 161083-22-3), with molecular formula C7H8F3NO4 and molecular weight 227.04 g/mol. IUPAC: methyl 2-ethoxycarbonylimino-3,3,3-trifluoropropanoate.
Chemical Property Profile of Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester
Property Insights of Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester
The XLogP value of 1.3192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester. The TPSA of 64.96 Ų falls within the moderate polarity range, balancing permeability and solubility for Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester. Following Lipinski's Rule of Five, Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester has 0 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 Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester?
The CAS number of Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester is 161083-22-3.
What is the molecular formula of Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester?
The molecular formula of Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester is C7H8F3NO4.
What is the molecular weight of Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester?
The molecular weight of Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester is 227.04 g/mol.
Where can I buy Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester?
You can request a quote for Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Propanoic acid, 2-[(ethoxycarbonyl)imino]-3,3,3-trifluoro-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.