Acetic acid, methylnitrosaminomethyl-d3 ester
TL;DR: Acetic acid, methylnitrosaminomethyl-d3 ester (CAS 67557-57-7) is a chemical compound with molecular formula C4H8N2O3 and molecular weight 135.07233 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[nitroso(trideuteriomethyl)amino]methyl acetate
Also Known As: Acetoxymethyltrideuteromethylnitrosamine, Trideuteromethyl acetoxymethylnitrosamine, Methyl(acetoxymethyl)nitrosamine, ACETIC ACID, METHYLNITROSAMINOMETHYL-d3 ESTER, Nitroso-N-(1-acetoxymethyl)trideuteromethylamine
Technical Specifications
| Molecular Formula | C4H8N2O3 |
| Molecular Weight | 135.07233 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 59.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 135.07233 Da |
| Heavy Atoms | 9 |
| Complexity | 114.0 |
| SMILES | [2H]C([2H])([2H])N(COC(=O)C)N=O |
| InChIKey | WBXQXRXMGCOVHA-BMSJAHLVSA-N |
Chemical Property Profile of Acetic acid, methylnitrosaminomethyl-d3 ester
Property Insights of Acetic acid, methylnitrosaminomethyl-d3 ester
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, methylnitrosaminomethyl-d3 ester. With a topological polar surface area (TPSA) of 59.0 Ų, Acetic acid, methylnitrosaminomethyl-d3 ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, methylnitrosaminomethyl-d3 ester has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetic acid, methylnitrosaminomethyl-d3 ester?
The CAS number of Acetic acid, methylnitrosaminomethyl-d3 ester is 67557-57-7.
What is the molecular formula of Acetic acid, methylnitrosaminomethyl-d3 ester?
The molecular formula of Acetic acid, methylnitrosaminomethyl-d3 ester is C4H8N2O3.
What is the molecular weight of Acetic acid, methylnitrosaminomethyl-d3 ester?
The molecular weight of Acetic acid, methylnitrosaminomethyl-d3 ester is 135.07233 g/mol.
Where can I buy Acetic acid, methylnitrosaminomethyl-d3 ester?
You can request a quote for Acetic acid, methylnitrosaminomethyl-d3 ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, methylnitrosaminomethyl-d3 ester?
Yes, CoreyChem provides custom synthesis services for Acetic acid, methylnitrosaminomethyl-d3 ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.