Scorodonin
TL;DR: Scorodonin (CAS 74660-77-8) is a chemical compound with molecular formula C7H7ClO and molecular weight 142.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chlorohepta-2,3-dien-5-yn-1-ol
Also Known As: Scorodonin, starbld0007515, 7-chlorohepta-2,3-dien-5-yn-1-ol, (R)-7-Chloro-2,3-heptadien-5-yn-1-ol, (R)-7-Chlorohepta-2,3-dien-5-yn-1-ol
| Molecular Formula | C7H7ClO |
|---|---|
| Molecular Weight | 142.02 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 142.01854 |
| Heavy Atoms | 9 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 74660-77-8 |
|---|---|
| SMILES | C(C=C=CC#CCCl)O |
| InChIKey | BRBJAAXWYUMXBE-UHFFFAOYSA-N |
Product Overview
Scorodonin (CAS 74660-77-8), with molecular formula C7H7ClO and molecular weight 142.02 g/mol. IUPAC: 7-chlorohepta-2,3-dien-5-yn-1-ol.
Chemical Property Profile of Scorodonin
Property Insights of Scorodonin
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Scorodonin. With a topological polar surface area (TPSA) of 20.2 Ų, Scorodonin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Scorodonin 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 Scorodonin?
The CAS number of Scorodonin is 74660-77-8.
What is the molecular formula of Scorodonin?
The molecular formula of Scorodonin is C7H7ClO.
What is the molecular weight of Scorodonin?
The molecular weight of Scorodonin is 142.02 g/mol.
Where can I buy Scorodonin?
You can request a quote for Scorodonin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Scorodonin?
Yes, KEHONG BIO provides custom synthesis services for Scorodonin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.