(+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol
TL;DR: (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol (CAS 95840-06-5) is a chemical compound with molecular formula C6H8O3 and molecular weight 128.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2S,3R,6R)-7-oxabicyclo[4.1.0]hept-4-ene-2,3-diol
Also Known As: 7-oxabicyclo[4.1.0]hept-4-ene-2,3-diol, (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol, (1S,2S,3R,6R)-7-OXABICYCLO[4.1.0]HEPT-4-ENE-2,3-DIOL, (+)-1-alpha,2-beta-Dihydroxy-3-beta,4-beta-epoxy-1,2,3,4-tetrahydrobenzene, (1R)-3alpha,4alpha-Epoxycyclohexa-5-ene-1beta,2alpha-diol
| Molecular Formula | C6H8O3 |
|---|---|
| Molecular Weight | 128.05 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.04735 |
| Heavy Atoms | 9 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 95840-06-5 |
|---|---|
| SMILES | C1=C[C@@H]2[C@@H](O2)[C@H]([C@@H]1O)O |
| InChIKey | JKZWMSHRWLYMOD-ARQDHWQXSA-N |
Product Overview
(+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol (CAS 95840-06-5), with molecular formula C6H8O3 and molecular weight 128.05 g/mol. IUPAC: (1S,2S,3R,6R)-7-oxabicyclo[4.1.0]hept-4-ene-2,3-diol.
Chemical Property Profile of (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol
Property Insights of (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol
The XLogP value of -1.1 indicates that (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 53.0 Ų, (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol has 2 hydrogen bond donor(s) and 3 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 (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol?
The CAS number of (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol is 95840-06-5.
What is the molecular formula of (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol?
The molecular formula of (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol is C6H8O3.
What is the molecular weight of (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol?
The molecular weight of (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol is 128.05 g/mol.
Where can I buy (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol?
You can request a quote for (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol?
Yes, KEHONG BIO provides custom synthesis services for (+)-(1S,2R,3S,6R)-7-Oxabicyclo(4.1.0)hept-4-ene-2,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.