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(2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate structure
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(2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate

TL;DR: (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate (CAS 93133-76-7) is a chemical compound with molecular formula C6H15O15P3 and molecular weight 419.96237 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

(2,3,5-trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate

Also Known As: PHOSPHONICACID, Dibrenzcatechinato-borsaeure, Inositol 1,3,4-triphosphate, I0146_SIGMA, inositol 1,3,4-trisphosphate

CAS Number
93133-76-7
Molecular Formula
C6H15O15P3
Molecular Weight
419.96237 g/mol
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Application Areas

Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (16 patents) Analytical Reagents (402 patents) Biotechnology (1132 patents) Catalysts (1 patents) Coatings & Adhesives (2 patents)

Technical Specifications

Molecular FormulaC6H15O15P3
Molecular Weight419.96237 g/mol
XLogP-7.0
Topological Polar Surface Area (TPSA)261.0 Ų
Hydrogen Bond Donors9
Hydrogen Bond Acceptors15
Rotatable Bonds6
Exact Mass419.96237 Da
Heavy Atoms24
Complexity574.0
SMILESC1(C(C(C(C(C1OP(=O)(O)O)O)OP(=O)(O)O)OP(=O)(O)O)O)O
InChIKeyMMWCIQZXVOZEGG-UHFFFAOYSA-N

Product Description

Applications: (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate is used in biotechnology workflows and life-science research, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

A biotechnology compound supplied by CoreyChem, (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate (CAS 93133-76-7) has the molecular formula C6H15O15P3 and a molecular weight of 419.96 g/mol. Synonyms include PHOSPHONICACID and Dibrenzcatechinato-borsaeure.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate

XLogP
-7.0
TPSA (Topological Polar Surface Area)
261.0
Hydrogen Bond Donors
9
Hydrogen Bond Acceptors
15
Rotatable Bonds
6
Heavy Atoms
24
Complexity
574.0
Exact Mass
419.96237
Monoisotopic Mass
419.96237
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate

The XLogP value of -7.0 indicates that (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 261.0 Ų indicates high polarity, suggesting (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate has 9 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate?

The CAS number of (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate is 93133-76-7.

What is the molecular formula of (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate?

The molecular formula of (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate is C6H15O15P3.

What is the molecular weight of (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate?

The molecular weight of (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate is 419.96237 g/mol.

What are the applications of (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate?

(2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate is used in biotechnology workflows and life-science research, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as...

Where can I buy (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate?

You can request a quote for (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate?

Yes, CoreyChem provides custom synthesis services for (2,3,5-Trihydroxy-4,6-diphosphonooxycyclohexyl) dihydrogen phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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