![methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate structure](/static/products/701/70122-96-2.png)
methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate
TL;DR: methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate (CAS 70122-96-2) is a chemical compound with molecular formula C11H12Cl3NO2 and molecular weight 294.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate
Also Known As: AB01104436-03, methyl (2,2,2-trichloro-1-(p-tolyl)ethyl)carbamate, methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate
| Molecular Formula | C11H12Cl3NO2 |
|---|---|
| Molecular Weight | 294.99 g/mol |
| LogP | 3.76232 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.99335 |
| Heavy Atoms | 17 |
| Complexity | 386.69818 |
Chemical Identifiers
| CAS Number | 70122-96-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(C(Cl)(Cl)Cl)NC(=O)OC |
Product Overview
methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate (CAS 70122-96-2), with molecular formula C11H12Cl3NO2 and molecular weight 294.99 g/mol. IUPAC: methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate.
Chemical Property Profile of methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate
Property Insights of methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate
The XLogP value of 3.76232 indicates that methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]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, methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]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 methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate?
The CAS number of methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate is 70122-96-2.
What is the molecular formula of methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate?
The molecular formula of methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate is C11H12Cl3NO2.
What is the molecular weight of methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate?
The molecular weight of methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate is 294.99 g/mol.
Where can I buy methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate?
You can request a quote for methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]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-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[2,2,2-trichloro-1-(4-methylphenyl)ethyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.