Ditrifluoromethyl(chlorocarbonyloxy)amine
TL;DR: Ditrifluoromethyl(chlorocarbonyloxy)amine (CAS 15496-01-2) is a chemical compound with molecular formula C3ClF6NO2 and molecular weight 230.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[bis(trifluoromethyl)amino] carbonochloridate
Also Known As: Ditrifluoromethyl(chlorocarbonyloxy)amine, [bis(trifluoromethyl)amino] carbonochloridate, {[Bis(trifluoromethyl)amino]oxy}(chloro)methanone, O-(chloroformyl)-N,N-bis(trifluoromethyl)hydroxylamine, O-(chloroformyl)-N,N-bis(trifluoro-methyl)hydroxyl-amine
| Molecular Formula | C3ClF6NO2 |
|---|---|
| Molecular Weight | 230.95 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.95218 |
| Heavy Atoms | 13 |
| Complexity | 185.0 |
Chemical Identifiers
| CAS Number | 15496-01-2 |
|---|---|
| SMILES | C(=O)(ON(C(F)(F)F)C(F)(F)F)Cl |
| InChIKey | ADPIJPFGLVDJEK-UHFFFAOYSA-N |
Product Overview
Ditrifluoromethyl(chlorocarbonyloxy)amine (CAS 15496-01-2), with molecular formula C3ClF6NO2 and molecular weight 230.95 g/mol. IUPAC: [bis(trifluoromethyl)amino] carbonochloridate.
Chemical Property Profile of Ditrifluoromethyl(chlorocarbonyloxy)amine
Property Insights of Ditrifluoromethyl(chlorocarbonyloxy)amine
The XLogP value of 3.8 indicates that Ditrifluoromethyl(chlorocarbonyloxy)amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Ditrifluoromethyl(chlorocarbonyloxy)amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ditrifluoromethyl(chlorocarbonyloxy)amine has 0 hydrogen bond donor(s) and 9 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 Ditrifluoromethyl(chlorocarbonyloxy)amine?
The CAS number of Ditrifluoromethyl(chlorocarbonyloxy)amine is 15496-01-2.
What is the molecular formula of Ditrifluoromethyl(chlorocarbonyloxy)amine?
The molecular formula of Ditrifluoromethyl(chlorocarbonyloxy)amine is C3ClF6NO2.
What is the molecular weight of Ditrifluoromethyl(chlorocarbonyloxy)amine?
The molecular weight of Ditrifluoromethyl(chlorocarbonyloxy)amine is 230.95 g/mol.
Where can I buy Ditrifluoromethyl(chlorocarbonyloxy)amine?
You can request a quote for Ditrifluoromethyl(chlorocarbonyloxy)amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ditrifluoromethyl(chlorocarbonyloxy)amine?
Yes, KEHONG BIO provides custom synthesis services for Ditrifluoromethyl(chlorocarbonyloxy)amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.