RefChem:311200
TL;DR: RefChem:311200 (CAS 109362-27-8) is a chemical compound with molecular formula C8H8Br2O5 and molecular weight 341.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,3S,4R,5S,6R)-5,6-dibromo-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid
Also Known As: NCIStruc1_000968, NCIStruc2_000911, 7-Oxabicyclo(2.2.1)heptane-2,3-dicarboxylic acid, 5,6-dibromo-, (1-alpha,2-alpha,3-alpha,4-alpha,5-alpha,6-alpha)-, (1R,2S,3R,4S,5R,6S)-5,6-DIBROMO-7-OXABICYCLO[2.2.1]HEPTANE-2,3-DICARBOXYLIC ACID, RefChem:311200
| Molecular Formula | C8H8Br2O5 |
|---|---|
| Molecular Weight | 341.87 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 83.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 341.87384 |
| Heavy Atoms | 15 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 109362-27-8 |
|---|---|
| SMILES | [C@H]1([C@@H]([C@@H]2[C@@H]([C@@H]([C@H]1O2)Br)Br)C(=O)O)C(=O)O |
| InChIKey | YAUAFDGEUWEBOP-XQVDCTMKSA-N |
Product Overview
RefChem:311200 (CAS 109362-27-8), with molecular formula C8H8Br2O5 and molecular weight 341.87 g/mol. IUPAC: (1S,2R,3S,4R,5S,6R)-5,6-dibromo-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic acid.
Chemical Property Profile of RefChem:311200
Property Insights of RefChem:311200
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:311200. The TPSA of 83.8 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:311200. Following Lipinski's Rule of Five, RefChem:311200 has 2 hydrogen bond donor(s) and 5 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 RefChem:311200?
The CAS number of RefChem:311200 is 109362-27-8.
What is the molecular formula of RefChem:311200?
The molecular formula of RefChem:311200 is C8H8Br2O5.
What is the molecular weight of RefChem:311200?
The molecular weight of RefChem:311200 is 341.87 g/mol.
Where can I buy RefChem:311200?
You can request a quote for RefChem:311200 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:311200?
Yes, KEHONG BIO provides custom synthesis services for RefChem:311200 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.