CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Clear yellow liquid; [TCI America MSDS] |
|---|---|
| Vapor Pressure | 0.000906 [mmHg] |
| Chemical Classes | Nitrogen Compounds -> Nitrosamines |
COMPUTED DESCRIPTORS
| Molecular Weight | 118.13 g/mol |
|---|---|
| XLogP3 | -0.1 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 3 |
| Exact Mass | 118.074227566 g/mol |
| Monoisotopic Mass | 118.074227566 g/mol |
| Topological Polar Surface Area | 52.9 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 67.1 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
N-ethyl-N-(2-hydroxyethyl)nitrosamine is a nitrosamine that is N-nitrosodiethylamine in which one of the ethyl froups has been replaced by a 2-hydroxyethyl group. It is used to induce renal and liver tumours in rodents. It has a role as a carcinogenic agent. It is a nitrosamine and a primary alcohol. It is functionally related to a N-nitrosodiethylamine.