2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate
TL;DR: 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate (CAS 301320-36-5) is a chemical compound with molecular formula C13H13F6NO2 and molecular weight 329.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3,5-trimethylphenyl) N-(1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate
Also Known As: 2,3,5-trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate, (2,3,5-trimethylphenyl) N-(1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate, N-[2,2,2-trifluoro-1-(trifluoromethyl)ethyl](2,3,5-trimethylphenoxy)carboxamid e
| Molecular Formula | C13H13F6NO2 |
|---|---|
| Molecular Weight | 329.09 g/mol |
| LogP | 4.19346 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 329.08505 |
| Heavy Atoms | 22 |
| Complexity | 550.8743 |
Chemical Identifiers
| CAS Number | 301320-36-5 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)OC(=O)NC(C(F)(F)F)C(F)(F)F)C)C |
Product Overview
2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate (CAS 301320-36-5), with molecular formula C13H13F6NO2 and molecular weight 329.09 g/mol. IUPAC: (2,3,5-trimethylphenyl) N-(1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate.
Chemical Property Profile of 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate
Property Insights of 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate
The XLogP value of 4.19346 indicates that 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.33 Ų, 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate has 1 hydrogen bond donor(s) and 2 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 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate?
The CAS number of 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate is 301320-36-5.
What is the molecular formula of 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate?
The molecular formula of 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate is C13H13F6NO2.
What is the molecular weight of 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate?
The molecular weight of 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate is 329.09 g/mol.
Where can I buy 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate?
You can request a quote for 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for 2,3,5-Trimethylphenyl (1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.