alpha-Amino-(4-hydroxybenzylidene)diphosphonate
TL;DR: alpha-Amino-(4-hydroxybenzylidene)diphosphonate (CAS 76330-16-0) is a chemical compound with molecular formula C7H11NO7P2 and molecular weight 283.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[amino-(4-hydroxyphenyl)-phosphonomethyl]phosphonic acid
Also Known As: BDP3, 4-[amino(diphosphonato)methyl]phenol, KST-1A8122, alpha-Amino-(4-hydroxybenzylidene)diphosphonate, [amino(4-hydroxyphenyl)methanediyl]bis(phosphonic acid)
| Molecular Formula | C7H11NO7P2 |
|---|---|
| Molecular Weight | 283.00 g/mol |
| LogP | -5.5 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.00107 |
| Heavy Atoms | 17 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 76330-16-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C(N)(P(=O)(O)O)P(=O)(O)O)O |
| InChIKey | AZKACZGHQQSQGL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
alpha-Amino-(4-hydroxybenzylidene)diphosphonate (CAS 76330-16-0), with molecular formula C7H11NO7P2 and molecular weight 283.00 g/mol. IUPAC: [amino-(4-hydroxyphenyl)-phosphonomethyl]phosphonic acid.
Chemical Property Profile of alpha-Amino-(4-hydroxybenzylidene)diphosphonate
Property Insights of alpha-Amino-(4-hydroxybenzylidene)diphosphonate
The XLogP value of -5.5 indicates that alpha-Amino-(4-hydroxybenzylidene)diphosphonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting alpha-Amino-(4-hydroxybenzylidene)diphosphonate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, alpha-Amino-(4-hydroxybenzylidene)diphosphonate has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of alpha-Amino-(4-hydroxybenzylidene)diphosphonate?
The CAS number of alpha-Amino-(4-hydroxybenzylidene)diphosphonate is 76330-16-0.
What is the molecular formula of alpha-Amino-(4-hydroxybenzylidene)diphosphonate?
The molecular formula of alpha-Amino-(4-hydroxybenzylidene)diphosphonate is C7H11NO7P2.
What is the molecular weight of alpha-Amino-(4-hydroxybenzylidene)diphosphonate?
The molecular weight of alpha-Amino-(4-hydroxybenzylidene)diphosphonate is 283.00 g/mol.
Where can I buy alpha-Amino-(4-hydroxybenzylidene)diphosphonate?
You can request a quote for alpha-Amino-(4-hydroxybenzylidene)diphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Amino-(4-hydroxybenzylidene)diphosphonate?
Yes, KEHONG BIO provides custom synthesis services for alpha-Amino-(4-hydroxybenzylidene)diphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.