1-(N-Methyl-N-nitrosoamino)ethyl phosphate
TL;DR: 1-(N-Methyl-N-nitrosoamino)ethyl phosphate (CAS 105514-32-7) is a chemical compound with molecular formula C3H9N2O5P and molecular weight 184.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[methyl(nitroso)amino]ethyl dihydrogen phosphate
Also Known As: 1-Mnep, 1-(N-Methyl-N-nitrosoamino)ethyl phosphate, 1-[methyl(nitroso)amino]ethyl dihydrogen phosphate, 1-[methyl(nitroso)amino]ethyl phosphate, 4-(4-Methylmercapto-phenyl)-thiazol-2-ylamin
| Molecular Formula | C3H9N2O5P |
|---|---|
| Molecular Weight | 184.02 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 99.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.0249 |
| Heavy Atoms | 11 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 105514-32-7 |
|---|---|
| SMILES | CC(N(C)N=O)OP(=O)(O)O |
| InChIKey | RAHRGNXSRYXRLP-UHFFFAOYSA-N |
Product Overview
1-(N-Methyl-N-nitrosoamino)ethyl phosphate (CAS 105514-32-7), with molecular formula C3H9N2O5P and molecular weight 184.02 g/mol. IUPAC: 1-[methyl(nitroso)amino]ethyl dihydrogen phosphate.
Chemical Property Profile of 1-(N-Methyl-N-nitrosoamino)ethyl phosphate
Property Insights of 1-(N-Methyl-N-nitrosoamino)ethyl phosphate
The XLogP value of -1.1 indicates that 1-(N-Methyl-N-nitrosoamino)ethyl phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(N-Methyl-N-nitrosoamino)ethyl phosphate. Following Lipinski's Rule of Five, 1-(N-Methyl-N-nitrosoamino)ethyl phosphate has 2 hydrogen bond donor(s) and 7 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 1-(N-Methyl-N-nitrosoamino)ethyl phosphate?
The CAS number of 1-(N-Methyl-N-nitrosoamino)ethyl phosphate is 105514-32-7.
What is the molecular formula of 1-(N-Methyl-N-nitrosoamino)ethyl phosphate?
The molecular formula of 1-(N-Methyl-N-nitrosoamino)ethyl phosphate is C3H9N2O5P.
What is the molecular weight of 1-(N-Methyl-N-nitrosoamino)ethyl phosphate?
The molecular weight of 1-(N-Methyl-N-nitrosoamino)ethyl phosphate is 184.02 g/mol.
Where can I buy 1-(N-Methyl-N-nitrosoamino)ethyl phosphate?
You can request a quote for 1-(N-Methyl-N-nitrosoamino)ethyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(N-Methyl-N-nitrosoamino)ethyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for 1-(N-Methyl-N-nitrosoamino)ethyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.