![(1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride structure](/static/products/305/305866-64-2.png)
(1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride
TL;DR: (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride (CAS 305866-64-2) is a chemical compound with molecular formula C13H14ClF3N2O3 and molecular weight 338.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-(1-chloro-2-methylpropylidene)amino] N-[2-methoxy-5-(trifluoromethyl)phenyl]carbamate
Also Known As: (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride, (E)-N-(((2-methoxy-5-(trifluoromethyl)phenyl)carbamoyl)oxy)isobutyrimidoyl chloride, [(E)-(1-chloro-2-methylpropylidene)amino] N-[2-methoxy-5-(trifluoromethyl)phenyl]carbamate, Propanimidoyl chloride, N-[[[[2-methoxy- 5-(trifluoromethyl)phenyl]amino]carbonyl]oxy]-2-methyl-
| Molecular Formula | C13H14ClF3N2O3 |
|---|---|
| Molecular Weight | 338.06 g/mol |
| LogP | 4.4708 |
| Topological Polar Surface Area | 59.92 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 338.0645 |
| Heavy Atoms | 22 |
| Complexity | 574.13904 |
Chemical Identifiers
| CAS Number | 305866-64-2 |
|---|---|
| SMILES | CC(C)/C(=N\OC(=O)NC1=C(C=CC(=C1)C(F)(F)F)OC)/Cl |
Product Overview
(1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride (CAS 305866-64-2), with molecular formula C13H14ClF3N2O3 and molecular weight 338.06 g/mol. IUPAC: [(E)-(1-chloro-2-methylpropylidene)amino] N-[2-methoxy-5-(trifluoromethyl)phenyl]carbamate.
Chemical Property Profile of (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride
Property Insights of (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride
The XLogP value of 4.4708 indicates that (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.92 Ų, (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride has 1 hydrogen bond donor(s) and 4 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 (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride?
The CAS number of (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride is 305866-64-2.
What is the molecular formula of (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride?
The molecular formula of (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride is C13H14ClF3N2O3.
What is the molecular weight of (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride?
The molecular weight of (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride is 338.06 g/mol.
Where can I buy (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride?
You can request a quote for (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for (1E)-N-({[2-methoxy-5-(trifluoromethyl)phenyl]carbamoyl}oxy)-2-methylpropanimidoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.