灭草灵
TL;DR: 灭草灵 (CAS 1918-18-9) is a chemical compound with molecular formula C8H7Cl2NO2 and molecular weight 218.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
灭草灵
methyl N-(3,4-dichlorophenyl)carbamate
Also Known As: SWEP, Methyl N-(3,4-dichlorophenyl)carbamate, Swep compound, Prostacidin, Regressin
| Molecular Formula | C8H7Cl2NO2 |
|---|---|
| Molecular Weight | 218.99 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.98538 |
| Heavy Atoms | 13 |
| Complexity | 189.0 |
| Melting Point | 113 °C |
| Boiling Point | BP: 110-113 °C /Technical/ |
| Solubility | INSOL IN WATER; INSOL IN KEROSENE; IN ACETONE 46% & DIISOBUTYL KETONE 19%; IN DIMETHYLFORMAMIDE 64% & ISOPHORONE 33%; IN XYLENE LESS THAN 2.5% |
| Vapor Pressure | 0.00139 [mmHg] |
Chemical Identifiers
| CAS Number | 1918-18-9 |
|---|---|
| SMILES | COC(=O)NC1=CC(=C(C=C1)Cl)Cl |
| InChIKey | WOZQBERUBLYCEG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
灭草灵 (CAS 1918-18-9), with molecular formula C8H7Cl2NO2 and molecular weight 218.99 g/mol. IUPAC: methyl N-(3,4-dichlorophenyl)carbamate.
Chemical Property Profile of 灭草灵
Property Insights of 灭草灵
The XLogP value of 3.5 indicates that 灭草灵 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 灭草灵 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 灭草灵 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 灭草灵?
The CAS number of 灭草灵 is 1918-18-9.
What is the molecular formula of 灭草灵?
The molecular formula of 灭草灵 is C8H7Cl2NO2.
What is the molecular weight of 灭草灵?
The molecular weight of 灭草灵 is 218.99 g/mol.
Where can I buy 灭草灵?
You can request a quote for 灭草灵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 灭草灵?
Yes, KEHONG BIO provides custom synthesis services for 灭草灵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.