2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate
TL;DR: 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate (CAS 128651-50-3) is a chemical compound with molecular formula C15H10F3NO5S and molecular weight 373.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1,3-dioxobenzo[f]isoindol-2-yl)ethyl trifluoromethanesulfonate
Also Known As: 2-Nie-tfms, Ester, NE-OTF, 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate, 2,6-Difluorophenylzinc bromide
| Molecular Formula | C15H10F3NO5S |
|---|---|
| Molecular Weight | 373.02 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 89.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 373.02316 |
| Heavy Atoms | 25 |
| Complexity | 625.0 |
Chemical Identifiers
| CAS Number | 128651-50-3 |
|---|---|
| SMILES | C1=CC=C2C=C3C(=CC2=C1)C(=O)N(C3=O)CCOS(=O)(=O)C(F)(F)F |
| InChIKey | VKCKBLUPFMXLRO-UHFFFAOYSA-N |
Product Overview
2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate (CAS 128651-50-3), with molecular formula C15H10F3NO5S and molecular weight 373.02 g/mol. IUPAC: 2-(1,3-dioxobenzo[f]isoindol-2-yl)ethyl trifluoromethanesulfonate.
Chemical Property Profile of 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate
Property Insights of 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate. Following Lipinski's Rule of Five, 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate 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 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate?
The CAS number of 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate is 128651-50-3.
What is the molecular formula of 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate?
The molecular formula of 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate is C15H10F3NO5S.
What is the molecular weight of 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate?
The molecular weight of 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate is 373.02 g/mol.
Where can I buy 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate?
You can request a quote for 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,3-Naphthalimino)ethyl trifluoromethanesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.