![ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate structure](/static/products/372/372174-66-8.png)
ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate
TL;DR: ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate (CAS 372174-66-8) is a chemical compound with molecular formula C14H14F6N2O4 and molecular weight 388.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[2-(1,3-benzodioxol-5-ylmethylamino)-1,1,1,3,3,3-hexafluoropropan-2-yl]carbamate
Also Known As: ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate, ethyl N-[2-(1,3-benzodioxol-5-ylmethylamino)-1,1,1,3,3,3-hexafluoropropan-2-yl]carbamate, ethyl (2-((benzo[d][1,3]dioxol-5-ylmethyl)amino)-1,1,1,3,3,3-hexafluoropropan-2-yl)carbamate, Ethyl N-[2-(benzo[1,3]dioxol-5-ylmethylamino)-1,1,1,3,3,3-hexafluoro-propan-2-yl]carbamate
| Molecular Formula | C14H14F6N2O4 |
|---|---|
| Molecular Weight | 388.09 g/mol |
| LogP | 3.0719 |
| Topological Polar Surface Area | 68.82 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 388.0858 |
| Heavy Atoms | 26 |
| Complexity | 647.81757 |
Chemical Identifiers
| CAS Number | 372174-66-8 |
|---|---|
| SMILES | CCOC(=O)NC(C(F)(F)F)(C(F)(F)F)NCC1=CC2=C(C=C1)OCO2 |
Product Overview
ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate (CAS 372174-66-8), with molecular formula C14H14F6N2O4 and molecular weight 388.09 g/mol. IUPAC: ethyl N-[2-(1,3-benzodioxol-5-ylmethylamino)-1,1,1,3,3,3-hexafluoropropan-2-yl]carbamate.
Chemical Property Profile of ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate
Property Insights of ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate
The XLogP value of 3.0719 indicates that ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.82 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate. Following Lipinski's Rule of Five, ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate has 2 hydrogen bond donor(s) and 5 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 ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate?
The CAS number of ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate is 372174-66-8.
What is the molecular formula of ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate?
The molecular formula of ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate is C14H14F6N2O4.
What is the molecular weight of ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate?
The molecular weight of ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate is 388.09 g/mol.
Where can I buy ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate?
You can request a quote for ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-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 ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl {2-[(1,3-benzodioxol-5-ylmethyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl}carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.