159939-87-4
Product Name:
O-ISOBUTYLS-(2-(DIETHYLAMINO)ETHYL)METHYLPHOSPHONOTHIOATE
Formula:
C11H26NO2PS
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Kovats Retention Index | 1689 1689 |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 267.37 g/mol |
|---|---|
| XLogP3 | 2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 9 |
| Exact Mass | 267.14218724 g/mol |
| Monoisotopic Mass | 267.14218724 g/mol |
| Topological Polar Surface Area | 54.8 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 220 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
VR nerve agent is a organic thiophosphate that is the isobutyl ester of S-[2-(diethylamino)ethyl] O hydrogen methylphosphonothioate. A toxic nerve agent developed by the former Soviet Union. It has a role as a neurotoxin and an EC 3.1.1.7 (acetylcholinesterase) inhibitor. It is an organic thiophosphate and a tertiary amino compound.