Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate
TL;DR: Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate (CAS 35801-45-7) is a chemical compound with molecular formula C10H11Cl3N2O2 and molecular weight 295.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate
Also Known As: methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate, methyl 1-anilino-2,2,2-trichloroethylcarbamate, Methyl N-(1-anilino-2,2,2-trichloro-ethyl)carbamate, 661-455-4, RefChem:817889
| Molecular Formula | C10H11Cl3N2O2 |
|---|---|
| Molecular Weight | 295.99 g/mol |
| LogP | 3.1508 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 295.98862 |
| Heavy Atoms | 17 |
| Complexity | 367.5638 |
Chemical Identifiers
| CAS Number | 35801-45-7 |
|---|---|
| SMILES | COC(=O)NC(C(Cl)(Cl)Cl)NC1=CC=CC=C1 |
Product Overview
Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate (CAS 35801-45-7), with molecular formula C10H11Cl3N2O2 and molecular weight 295.99 g/mol. IUPAC: methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate.
Chemical Property Profile of Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate
Property Insights of Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate
The XLogP value of 3.1508 indicates that Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate has 2 hydrogen bond donor(s) and 3 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 Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate?
The CAS number of Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate is 35801-45-7.
What is the molecular formula of Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate?
The molecular formula of Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate is C10H11Cl3N2O2.
What is the molecular weight of Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate?
The molecular weight of Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate is 295.99 g/mol.
Where can I buy Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate?
You can request a quote for Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Methyl N-(1-anilino-2,2,2-trichloroethyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.