Inositol 1,2-bisphosphate
TL;DR: Inositol 1,2-bisphosphate (CAS 69256-53-7) is a chemical compound with molecular formula C6H14O12P2 and molecular weight 340.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2S,3R,4R,5R,6R)-2,3,4,5-tetrahydroxy-6-phosphonooxycyclohexyl] dihydrogen phosphate
Also Known As: Inositol 1,2-bisphosphate, L-myo-Inositol 3,4-bisphosphoric acid, D-myo-Inositol, 3,4-bis(dihydrogen phosphate), J2.516.424E, [(1R,2S,3R,4R,5R,6R)-2,3,4,5-tetrahydroxy-6-phosphonooxycyclohexyl] dihydrogen phosphate
| Molecular Formula | C6H14O12P2 |
|---|---|
| Molecular Weight | 340.00 g/mol |
| LogP | -5.9 |
| Topological Polar Surface Area | 214.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.99606 |
| Heavy Atoms | 20 |
| Complexity | 388.0 |
Chemical Identifiers
| CAS Number | 69256-53-7 |
|---|---|
| SMILES | [C@H]1([C@H]([C@@H]([C@H]([C@@H]([C@@H]1O)OP(=O)(O)O)OP(=O)(O)O)O)O)O |
| InChIKey | MCKAJXMRULSUKI-XCMZKKERSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Inositol 1,2-bisphosphate (CAS 69256-53-7), with molecular formula C6H14O12P2 and molecular weight 340.00 g/mol. IUPAC: [(1R,2S,3R,4R,5R,6R)-2,3,4,5-tetrahydroxy-6-phosphonooxycyclohexyl] dihydrogen phosphate.
Chemical Property Profile of Inositol 1,2-bisphosphate
Property Insights of Inositol 1,2-bisphosphate
The XLogP value of -5.9 indicates that Inositol 1,2-bisphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 214.0 Ų indicates high polarity, suggesting Inositol 1,2-bisphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Inositol 1,2-bisphosphate has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Inositol 1,2-bisphosphate?
The CAS number of Inositol 1,2-bisphosphate is 69256-53-7.
What is the molecular formula of Inositol 1,2-bisphosphate?
The molecular formula of Inositol 1,2-bisphosphate is C6H14O12P2.
What is the molecular weight of Inositol 1,2-bisphosphate?
The molecular weight of Inositol 1,2-bisphosphate is 340.00 g/mol.
Where can I buy Inositol 1,2-bisphosphate?
You can request a quote for Inositol 1,2-bisphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Inositol 1,2-bisphosphate?
Yes, KEHONG BIO provides custom synthesis services for Inositol 1,2-bisphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.