乙氯维诺
TL;DR: 乙氯维诺 (CAS 113-18-8) is a chemical compound with molecular formula C7H9ClO and molecular weight 144.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙氯维诺
1-chloro-3-ethylpent-1-en-4-yn-3-ol
Also Known As: ethchlorvynol, Rimonabant, 1-chloro-3-ethylpent-1-en-4-yn-3-ol, 1-Chloro-3-ethyl-1-penten-4-yn-3-ol, Ethchlorvynol (1.0mg/ml in Acetonitrile)
| Molecular Formula | C7H9ClO |
|---|---|
| Molecular Weight | 144.03 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 144.0342 |
| Heavy Atoms | 9 |
| Complexity | 154.0 |
| Melting Point | < 25 °C |
| Solubility | 1.43e-01 g/L |
Chemical Identifiers
| CAS Number | 113-18-8 |
|---|---|
| SMILES | CCC(C=CCl)(C#C)O |
| InChIKey | ZEHYJZXQEQOSON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
乙氯维诺 (CAS 113-18-8), with molecular formula C7H9ClO and molecular weight 144.03 g/mol. IUPAC: 1-chloro-3-ethylpent-1-en-4-yn-3-ol.
Chemical Property Profile of 乙氯维诺
Property Insights of 乙氯维诺
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 乙氯维诺. With a topological polar surface area (TPSA) of 20.2 Ų, 乙氯维诺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙氯维诺 has 1 hydrogen bond donor(s) and 1 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 乙氯维诺?
The CAS number of 乙氯维诺 is 113-18-8.
What is the molecular formula of 乙氯维诺?
The molecular formula of 乙氯维诺 is C7H9ClO.
What is the molecular weight of 乙氯维诺?
The molecular weight of 乙氯维诺 is 144.03 g/mol.
Where can I buy 乙氯维诺?
You can request a quote for 乙氯维诺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙氯维诺?
Yes, KEHONG BIO provides custom synthesis services for 乙氯维诺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.