NCIOpen2_008986
TL;DR: NCIOpen2_008986 (CAS 29050-59-7) is a chemical compound with molecular formula C8H14O8S2 and molecular weight 302.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-methylsulfonyloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl) methanesulfonate
Also Known As: NCIOpen2_008986, NCIOpen2_009239, NCIOpen2_009279, KST-1B2743, 1,4:3,6-dianhydro-2,5-bis-o-(methylsulfonyl)hexitol
| Molecular Formula | C8H14O8S2 |
|---|---|
| Molecular Weight | 302.01 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 122.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.013 |
| Heavy Atoms | 18 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 29050-59-7 |
|---|---|
| SMILES | CS(=O)(=O)OC1COC2C1OCC2OS(=O)(=O)C |
| InChIKey | CFHDLWAMOHQNTF-UHFFFAOYSA-N |
Product Overview
NCIOpen2_008986 (CAS 29050-59-7), with molecular formula C8H14O8S2 and molecular weight 302.01 g/mol. IUPAC: (6-methylsulfonyloxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl) methanesulfonate.
Chemical Property Profile of NCIOpen2_008986
Property Insights of NCIOpen2_008986
The XLogP value of -1.4 indicates that NCIOpen2_008986 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 122.0 Ų falls within the moderate polarity range, balancing permeability and solubility for NCIOpen2_008986. Following Lipinski's Rule of Five, NCIOpen2_008986 has 0 hydrogen bond donor(s) and 8 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 NCIOpen2_008986?
The CAS number of NCIOpen2_008986 is 29050-59-7.
What is the molecular formula of NCIOpen2_008986?
The molecular formula of NCIOpen2_008986 is C8H14O8S2.
What is the molecular weight of NCIOpen2_008986?
The molecular weight of NCIOpen2_008986 is 302.01 g/mol.
Where can I buy NCIOpen2_008986?
You can request a quote for NCIOpen2_008986 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NCIOpen2_008986?
Yes, KEHONG BIO provides custom synthesis services for NCIOpen2_008986 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.