aeroplysinin
TL;DR: aeroplysinin (CAS 28656-91-9) is a chemical compound with molecular formula C9H9Br2NO3 and molecular weight 336.89493 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3,5-dibromo-1,6-dihydroxy-4-methoxycyclohexa-2,4-dien-1-yl)acetonitrile
Also Known As: aeroplysinin, Aeroplysinin I, (+)-Aeroplysinin-1, KST-1A4114, SMP2_000153
Technical Specifications
| Molecular Formula | C9H9Br2NO3 |
| Molecular Weight | 336.89493 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 73.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 338.89288 Da |
| Heavy Atoms | 15 |
| Complexity | 382.0 |
| SMILES | COC1=C(C(C(C=C1Br)(CC#N)O)O)Br |
| InChIKey | BGYNLOSBKBOJJD-UHFFFAOYSA-N |
Product Description
Applications: aeroplysinin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies aeroplysinin (CAS 28656-91-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A fine chemical supplied by CoreyChem, aeroplysinin (CAS 28656-91-9) has the molecular formula C9H9Br2NO3 and a molecular weight of 336.89 g/mol. It is also known as aeroplysinin and Aeroplysinin I.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of aeroplysinin
Property Insights of aeroplysinin
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for aeroplysinin. The TPSA of 73.5 Ų falls within the moderate polarity range, balancing permeability and solubility for aeroplysinin. Following Lipinski's Rule of Five, aeroplysinin has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of aeroplysinin?
The CAS number of aeroplysinin is 28656-91-9.
What is the molecular formula of aeroplysinin?
The molecular formula of aeroplysinin is C9H9Br2NO3.
What is the molecular weight of aeroplysinin?
The molecular weight of aeroplysinin is 336.89493 g/mol.
What are the applications of aeroplysinin?
aeroplysinin is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies aeroplysinin (CAS 28656-91-9) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and...
Where can I buy aeroplysinin?
You can request a quote for aeroplysinin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for aeroplysinin?
Yes, CoreyChem provides custom synthesis services for aeroplysinin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.