Inositol 1,4-bis(phosphate)
TL;DR: Inositol 1,4-bis(phosphate) (CAS 77928-70-2) 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.
[(2S,3R,5S,6S)-2,3,5,6-tetrahydroxy-4-phosphonooxycyclohexyl] dihydrogen phosphate
Also Known As: Inositol diphosphate, Inositol 1,4-diphosphate, inositol 1,4-bisphosphate, inositol 1,4-bis(phosphate), myo-inositol 1,4-bisphosphate
| 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 | 372.0 |
Chemical Identifiers
| CAS Number | 77928-70-2 |
|---|---|
| SMILES | [C@H]1([C@@H](C([C@H]([C@@H](C1OP(=O)(O)O)O)O)OP(=O)(O)O)O)O |
| InChIKey | PELZSPZCXGTUMR-OHMVJDTGSA-N |
Product Overview
Inositol 1,4-bis(phosphate) (CAS 77928-70-2), with molecular formula C6H14O12P2 and molecular weight 340.00 g/mol. IUPAC: [(2S,3R,5S,6S)-2,3,5,6-tetrahydroxy-4-phosphonooxycyclohexyl] dihydrogen phosphate.
Chemical Property Profile of Inositol 1,4-bis(phosphate)
Property Insights of Inositol 1,4-bis(phosphate)
The XLogP value of -5.9 indicates that Inositol 1,4-bis(phosphate) 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 1,4-bis(phosphate) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Inositol 1,4-bis(phosphate) 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 1,4-bis(phosphate)?
The CAS number of Inositol 1,4-bis(phosphate) is 77928-70-2.
What is the molecular formula of Inositol 1,4-bis(phosphate)?
The molecular formula of Inositol 1,4-bis(phosphate) is C6H14O12P2.
What is the molecular weight of Inositol 1,4-bis(phosphate)?
The molecular weight of Inositol 1,4-bis(phosphate) is 340.00 g/mol.
Where can I buy Inositol 1,4-bis(phosphate)?
You can request a quote for Inositol 1,4-bis(phosphate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Inositol 1,4-bis(phosphate)?
Yes, KEHONG BIO provides custom synthesis services for Inositol 1,4-bis(phosphate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.