Phosphovanillin
TL;DR: Phosphovanillin (CAS 78456-97-0) is a chemical compound with molecular formula C8H9O6P and molecular weight 232.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-formyl-2-methoxyphenyl) dihydrogen phosphate
Also Known As: Phosphovanillin, 4-formyl-2-methoxyphenyl dihydrogen phosphate, Benzaldehyde, 3-methoxy-4-(phosphonooxy)-, (4-formyl-2-methoxyphenyl) dihydrogen phosphate, (4-formyl-2-methoxyphenoxy)phosphonic acid
| Molecular Formula | C8H9O6P |
|---|---|
| Molecular Weight | 232.01 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.01367 |
| Heavy Atoms | 15 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 78456-97-0 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)C=O)OP(=O)(O)O |
| InChIKey | GSWZGTLWVRFGIJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phosphovanillin (CAS 78456-97-0), with molecular formula C8H9O6P and molecular weight 232.01 g/mol. IUPAC: (4-formyl-2-methoxyphenyl) dihydrogen phosphate.
Chemical Property Profile of Phosphovanillin
Property Insights of Phosphovanillin
The XLogP value of -0.3 indicates that Phosphovanillin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphovanillin. Following Lipinski's Rule of Five, Phosphovanillin has 2 hydrogen bond donor(s) and 6 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 Phosphovanillin?
The CAS number of Phosphovanillin is 78456-97-0.
What is the molecular formula of Phosphovanillin?
The molecular formula of Phosphovanillin is C8H9O6P.
What is the molecular weight of Phosphovanillin?
The molecular weight of Phosphovanillin is 232.01 g/mol.
Where can I buy Phosphovanillin?
You can request a quote for Phosphovanillin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphovanillin?
Yes, KEHONG BIO provides custom synthesis services for Phosphovanillin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.