![Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate structure](/static/products/493/4936-46-3.png)
Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate
TL;DR: Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate (CAS 4936-46-3) is a chemical compound with molecular formula C6H12NO5P and molecular weight 209.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl [(E)-4-(methylamino)-4-oxobut-2-en-2-yl] hydrogen phosphate
Also Known As: methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate, Methoxy-[(E)-1-(methylcarbamoyl)prop-1-en-2-yl]oxy-phosphinic Acid, methyl (2E)-4-(methylamino)-4-oxobut-2-en-2-yl hydrogen (S)-phosphate, methyl [(E)-4-(methylamino)-4-oxobut-2-en-2-yl] hydrogen phosphate, Methyl (1E)-1-methyl-3-(methylamino)-3-oxo-1-propen-1-yl hydrogen phosphate
| Molecular Formula | C6H12NO5P |
|---|---|
| Molecular Weight | 209.05 g/mol |
| LogP | 0.3996 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 209.0453 |
| Heavy Atoms | 13 |
| Complexity | 261.7502 |
Chemical Identifiers
| CAS Number | 4936-46-3 |
|---|---|
| SMILES | C/C(=C\C(=O)NC)/OP(=O)(O)OC |
Product Overview
Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate (CAS 4936-46-3), with molecular formula C6H12NO5P and molecular weight 209.05 g/mol. IUPAC: methyl [(E)-4-(methylamino)-4-oxobut-2-en-2-yl] hydrogen phosphate.
Chemical Property Profile of Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate
Property Insights of Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate
The XLogP value of 0.3996 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate. Following Lipinski's Rule of Five, Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate has 2 hydrogen bond donor(s) and 4 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 Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate?
The CAS number of Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate is 4936-46-3.
What is the molecular formula of Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate?
The molecular formula of Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate is C6H12NO5P.
What is the molecular weight of Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate?
The molecular weight of Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate is 209.05 g/mol.
Where can I buy Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate?
You can request a quote for Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate?
Yes, KEHONG BIO provides custom synthesis services for Methyl [4-(methylamino)-4-oxidanylidene-but-2-en-2-yl] hydrogen phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.