![1-[Tert-butyl(nitroso)amino]ethyl acetate structure](/static/products/8126/81264-59-7.webp)
1-[Tert-butyl(nitroso)amino]ethyl acetate
TL;DR: 1-[Tert-butyl(nitroso)amino]ethyl acetate (CAS 81264-59-7) is a chemical compound with molecular formula C8H16N2O3 and molecular weight 188.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[tert-butyl(nitroso)amino]ethyl acetate
Also Known As: 1-( ethanolacetate, 1-[tert-butyl(nitroso)amino]ethyl acetate, tert-Butyl(1-acetoxyethyl)nitrosamine, 1-((1-Dimethylethyl)nitrosoamino)ethanol acetate (ester), Ethanol, 1-((1-dimethylethyl)nitrosoamino)-, acetate (ester)
| Molecular Formula | C8H16N2O3 |
|---|---|
| Molecular Weight | 188.12 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 188.11609 |
| Heavy Atoms | 13 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 81264-59-7 |
|---|---|
| SMILES | CC(N(C(C)(C)C)N=O)OC(=O)C |
| InChIKey | WVZHNMCTZYSTND-UHFFFAOYSA-N |
Product Overview
1-[Tert-butyl(nitroso)amino]ethyl acetate (CAS 81264-59-7), with molecular formula C8H16N2O3 and molecular weight 188.12 g/mol. IUPAC: 1-[tert-butyl(nitroso)amino]ethyl acetate.
Chemical Property Profile of 1-[Tert-butyl(nitroso)amino]ethyl acetate
Property Insights of 1-[Tert-butyl(nitroso)amino]ethyl acetate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[Tert-butyl(nitroso)amino]ethyl acetate. With a topological polar surface area (TPSA) of 59.0 Ų, 1-[Tert-butyl(nitroso)amino]ethyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[Tert-butyl(nitroso)amino]ethyl acetate 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
Frequently Asked Questions
What is the CAS number of 1-[Tert-butyl(nitroso)amino]ethyl acetate?
The CAS number of 1-[Tert-butyl(nitroso)amino]ethyl acetate is 81264-59-7.
What is the molecular formula of 1-[Tert-butyl(nitroso)amino]ethyl acetate?
The molecular formula of 1-[Tert-butyl(nitroso)amino]ethyl acetate is C8H16N2O3.
What is the molecular weight of 1-[Tert-butyl(nitroso)amino]ethyl acetate?
The molecular weight of 1-[Tert-butyl(nitroso)amino]ethyl acetate is 188.12 g/mol.
Where can I buy 1-[Tert-butyl(nitroso)amino]ethyl acetate?
You can request a quote for 1-[Tert-butyl(nitroso)amino]ethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[Tert-butyl(nitroso)amino]ethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 1-[Tert-butyl(nitroso)amino]ethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.