丁草胺
TL;DR: 丁草胺 (CAS 23184-66-9) is a chemical compound with molecular formula C17H26ClNO2 and molecular weight 311.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁草胺
N-(butoxymethyl)-2-chloro-N-(2,6-diethylphenyl)acetamide
Also Known As: BUTACHLOR, Machette, Machete, Bilchlor, Hiltachlor
| Molecular Formula | C17H26ClNO2 |
|---|---|
| Molecular Weight | 311.17 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 311.1652 |
| Heavy Atoms | 21 |
| Complexity | 287.0 |
| Melting Point | <-5 °C |
| Boiling Point | 156 °C at 0.5 mm Hg |
| Density | 1.070 g/mL at 25 °C |
| Solubility | Soluble in most organic solvents, including diethyl ether, acetone, benzene, ethanol, ethyl acetate, and hexane |
| Flash Point | 114 °C (open cup); 93 °C (closed cup) |
| Vapor Pressure | 0.0000029 [mmHg] |
Chemical Identifiers
| CAS Number | 23184-66-9 |
|---|---|
| SMILES | CCCCOCN(C1=C(C=CC=C1CC)CC)C(=O)CCl |
| InChIKey | HKPHPIREJKHECO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁草胺 (CAS 23184-66-9), with molecular formula C17H26ClNO2 and molecular weight 311.17 g/mol. IUPAC: N-(butoxymethyl)-2-chloro-N-(2,6-diethylphenyl)acetamide.
Chemical Property Profile of 丁草胺
Property Insights of 丁草胺
The XLogP value of 4.5 indicates that 丁草胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 丁草胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丁草胺 has 0 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 丁草胺?
The CAS number of 丁草胺 is 23184-66-9.
What is the molecular formula of 丁草胺?
The molecular formula of 丁草胺 is C17H26ClNO2.
What is the molecular weight of 丁草胺?
The molecular weight of 丁草胺 is 311.17 g/mol.
Where can I buy 丁草胺?
You can request a quote for 丁草胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁草胺?
Yes, KEHONG BIO provides custom synthesis services for 丁草胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.