![tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate structure](/static/products/2668/26684-29-7.webp)
tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate
TL;DR: tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate (CAS 26684-29-7) 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.
tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate
Also Known As: tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate, TERT-BUTYL 3,5-BIS(TRIFLUOROMETHYL)PHENYLCARBAMATE, tert-Butyl (3,5-bis(trifluoromethyl)phenyl)carbamate, tert-butyl [3,5-bis(trifluoromethyl)phenyl]carbamate
| Molecular Formula | C13H13F6NO2 |
|---|---|
| Molecular Weight | 329.09 g/mol |
| LogP | 5.0712 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 329.08505 |
| Heavy Atoms | 22 |
| Complexity | 524.86945 |
Chemical Identifiers
| CAS Number | 26684-29-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F |
Product Overview
tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate (CAS 26684-29-7), with molecular formula C13H13F6NO2 and molecular weight 329.09 g/mol. IUPAC: tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate.
Chemical Property Profile of tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate
Property Insights of tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate
The XLogP value of 5.0712 indicates that tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]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, tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate?
The CAS number of tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate is 26684-29-7.
What is the molecular formula of tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate?
The molecular formula of tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate is C13H13F6NO2.
What is the molecular weight of tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate?
The molecular weight of tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate is 329.09 g/mol.
Where can I buy tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate?
You can request a quote for tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl N-[3,5-bis(trifluoromethyl)phenyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.