Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate)
TL;DR: Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate) (CAS 672-06-0) is a chemical compound with molecular formula C11H13Cl2NO2 and molecular weight 261.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dichloro-5-ethyl-3-methylphenyl) N-methylcarbamate
Also Known As: 2,4-Dichloro-5-ethyl-3-methylphenol methylcarbamate, m-Cresol-2,4-dichloro-5-ethyl N-methylcarbamate, CARBAMIC ACID, METHYL-, 2,4-DICHLORO-5-ETHYL-m-TOLYL ESTER, (2,4-dichloro-5-ethyl-3-methylphenyl) N-methylcarbamate, Phenol, 2,4-dichloro-5-ethyl-3-methyl-, methylcarbamate
| Molecular Formula | C11H13Cl2NO2 |
|---|---|
| Molecular Weight | 261.03 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.03235 |
| Heavy Atoms | 16 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 672-06-0 |
|---|---|
| SMILES | CCC1=CC(=C(C(=C1Cl)C)Cl)OC(=O)NC |
| InChIKey | AZXKDALZKPSQGB-UHFFFAOYSA-N |
Product Overview
Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate) (CAS 672-06-0), with molecular formula C11H13Cl2NO2 and molecular weight 261.03 g/mol. IUPAC: (2,4-dichloro-5-ethyl-3-methylphenyl) N-methylcarbamate.
Chemical Property Profile of Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate)
Property Insights of Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate)
The XLogP value of 3.9 indicates that Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate) 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 Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate)?
The CAS number of Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate) is 672-06-0.
What is the molecular formula of Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate)?
The molecular formula of Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate) is C11H13Cl2NO2.
What is the molecular weight of Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate)?
The molecular weight of Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate) is 261.03 g/mol.
Where can I buy Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate)?
You can request a quote for Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate)?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2,4-dichloro-5-ethyl-3-methyl-, 1-(N-methylcarbamate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.