1D-myo-inositol 6-phosphate
TL;DR: 1D-myo-inositol 6-phosphate (CAS 111901-84-9) is a chemical compound with molecular formula C6H13O9P and molecular weight 260.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl] dihydrogen phosphate
Also Known As: inositol phosphate, Ins6P, inositol 1-phosphate, inositol 4-phosphate, Inositol 4-monophosphate
| Molecular Formula | C6H13O9P |
|---|---|
| Molecular Weight | 260.03 g/mol |
| LogP | -4.8 |
| Topological Polar Surface Area | 168.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.02972 |
| Heavy Atoms | 16 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 111901-84-9 |
|---|---|
| SMILES | [C@@H]1([C@H](C([C@H]([C@@H](C1O)O)O)OP(=O)(O)O)O)O |
| InChIKey | INAPMGSXUVUWAF-WWHKVMGRSA-N |
Product Overview
1D-myo-inositol 6-phosphate (CAS 111901-84-9), with molecular formula C6H13O9P and molecular weight 260.03 g/mol. IUPAC: [(2R,3R,5R,6S)-2,3,4,5,6-pentahydroxycyclohexyl] dihydrogen phosphate.
Chemical Property Profile of 1D-myo-inositol 6-phosphate
Property Insights of 1D-myo-inositol 6-phosphate
The XLogP value of -4.8 indicates that 1D-myo-inositol 6-phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 168.0 Ų indicates high polarity, suggesting 1D-myo-inositol 6-phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1D-myo-inositol 6-phosphate has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1D-myo-inositol 6-phosphate?
The CAS number of 1D-myo-inositol 6-phosphate is 111901-84-9.
What is the molecular formula of 1D-myo-inositol 6-phosphate?
The molecular formula of 1D-myo-inositol 6-phosphate is C6H13O9P.
What is the molecular weight of 1D-myo-inositol 6-phosphate?
The molecular weight of 1D-myo-inositol 6-phosphate is 260.03 g/mol.
Where can I buy 1D-myo-inositol 6-phosphate?
You can request a quote for 1D-myo-inositol 6-phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1D-myo-inositol 6-phosphate?
Yes, KEHONG BIO provides custom synthesis services for 1D-myo-inositol 6-phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.