Mycorrhizin a
TL;DR: Mycorrhizin a (CAS 64356-85-0) is a chemical compound with molecular formula C14H15ClO4 and molecular weight 282.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1aR,3aS,7aR)-5-[(Z)-1-chloroprop-1-enyl]-3a-hydroxy-2,2-dimethyl-1,1a-dihydrocyclopropa[c][1]benzofuran-4,7-dione
Also Known As: Mycorrhizin a, (1aR,3aS,7aR)-5-[(Z)-1-chloroprop-1-enyl]-3a-hydroxy-2,2-dimethyl-1,1a-dihydrocyclopropa[c][1]benzofuran-4,7-dione
| Molecular Formula | C14H15ClO4 |
|---|---|
| Molecular Weight | 282.07 g/mol |
| LogP | 1.7109 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 282.0659 |
| Heavy Atoms | 19 |
| Complexity | 573.99506 |
Chemical Identifiers
| CAS Number | 64356-85-0 |
|---|---|
| SMILES | C/C=C(/C1=CC(=O)[C@@]23C[C@H]2C(O[C@@]3(C1=O)O)(C)C)\Cl |
Product Overview
Mycorrhizin a (CAS 64356-85-0), with molecular formula C14H15ClO4 and molecular weight 282.07 g/mol. IUPAC: (1aR,3aS,7aR)-5-[(Z)-1-chloroprop-1-enyl]-3a-hydroxy-2,2-dimethyl-1,1a-dihydrocyclopropa[c][1]benzofuran-4,7-dione.
Chemical Property Profile of Mycorrhizin a
Property Insights of Mycorrhizin a
The XLogP value of 1.7109 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Mycorrhizin a. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Mycorrhizin a. Following Lipinski's Rule of Five, Mycorrhizin a has 1 hydrogen bond donor(s) and 4 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 Mycorrhizin a?
The CAS number of Mycorrhizin a is 64356-85-0.
What is the molecular formula of Mycorrhizin a?
The molecular formula of Mycorrhizin a is C14H15ClO4.
What is the molecular weight of Mycorrhizin a?
The molecular weight of Mycorrhizin a is 282.07 g/mol.
Where can I buy Mycorrhizin a?
You can request a quote for Mycorrhizin a directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mycorrhizin a?
Yes, KEHONG BIO provides custom synthesis services for Mycorrhizin a and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.