Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester
TL;DR: Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester (CAS 33698-06-5) is a chemical compound with molecular formula C6H12NO6P and molecular weight 225.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(Z)-4-amino-3-hydroxy-4-oxobut-2-en-2-yl] dimethyl phosphate
Also Known As: Vinyl hydroxy phosphamidon amide, (Z)-3-dimethoxyphosphoryloxy-2-hydroxy-but-2-enamide, Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester, [(Z)-4-amino-3-hydroxy-4-oxobut-2-en-2-yl] dimethyl phosphate
| Molecular Formula | C6H12NO6P |
|---|---|
| Molecular Weight | 225.04 g/mol |
| LogP | 0.6787 |
| Topological Polar Surface Area | 108.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 225.04022 |
| Heavy Atoms | 14 |
| Complexity | 290.69687 |
Chemical Identifiers
| CAS Number | 33698-06-5 |
|---|---|
| SMILES | C/C(=C(\C(=O)N)/O)/OP(=O)(OC)OC |
Product Overview
Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester (CAS 33698-06-5), with molecular formula C6H12NO6P and molecular weight 225.04 g/mol. IUPAC: [(Z)-4-amino-3-hydroxy-4-oxobut-2-en-2-yl] dimethyl phosphate.
Chemical Property Profile of Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester
Property Insights of Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester
The XLogP value of 0.6787 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester. The TPSA of 108.08 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester. Following Lipinski's Rule of Five, Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester 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 Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester?
The CAS number of Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester is 33698-06-5.
What is the molecular formula of Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester?
The molecular formula of Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester is C6H12NO6P.
What is the molecular weight of Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester?
The molecular weight of Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester is 225.04 g/mol.
Where can I buy Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester?
You can request a quote for Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoric acid, 3-amino-2-hydroxy-1-methyl-3-oxo-1-propen-1-yl dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.