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| CAS No.: | 22936-17-0 |
|---|---|
| Name: | O,O-diethyl O-{4-[(1Z)-N-{[(1-methylethyl)carbamoyl]oxy}ethanimidoyl]phenyl} thiophosphate |
| Molecular Structure: | |
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| Formula: | C16H25 N2 O5 P S |
| Molecular Weight: | 388.425 |
| Synonyms: | Acetophenone,4'-hydroxy-, O-(isopropylcarbamoyl)oxime, O-ester with O,O-diethylphosphorothioate (8CI) |
| Density: | 1.21g/cm3 |
| Boiling Point: | °Cat760mmHg |
| Flash Point: | °C |
| Hazard Symbols: | A poison by ingestion. |
| Safety: | A poison by ingestion. When heated to decomposition it emits toxic vapors of NOx, SOx, and POx. |
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Chemistry
Empirical Formula of Acetophenone, 4'-hydroxy-, O-(isopropylcarbamoyl)oxime, O-ester with O,O-diethyl phosphorothio (CAS NO.22936-17-0): C16H25N2O5PS
Molecular Weight: 388.4189
Index of Refraction: 1.536
Density: 1.21 g/cm3
Structure of Acetophenone, 4'-hydroxy-, O-(isopropylcarbamoyl)oxime, O-ester with O,O-diethyl phosphorothio (CAS NO.22936-17-0):
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IUPAC Name: [(Z)-1-(4-Diethoxyphosphinothioyloxyphenyl)ethylideneamino]N-propan-2-ylcarbamate
Canonical SMILES: CCOP(=S)(OCC)OC1=CC=C(C=C1)C(=NOC(=O)NC(C)C)C
Isomeric SMILES: CCOP(=S)(OCC)OC1=CC=C(C=C1)/C(=N\OC(=O)NC(C)C)/C
InChI: InChI=1S/C16H25N2O5PS/c1-6-20-24(25,21-7-2)23-15-10-8-14(9-11-15)13(5)18-22-16(19)17-12(3)4/h8-12H,6-7H2,1-5H3,(H,17,19)/b18-13-
InChIKey: GUEQBXINXBQHEA-AQTBWJFISA-N
Toxicity Data With Reference
| 1. | orl-mus LDLo:400 mg/kg | USXXAM United States Patent Document. (Commissioner of Patents and Trademarks, Washington, DC 20231) #3681476 . |
Safety Profile
A poison by ingestion. When heated to decomposition Acetophenone, 4'-hydroxy-, O-(isopropylcarbamoyl)oxime, O-ester with O,O-diethyl phosphorothio (CAS NO.22936-17-0) emits toxic vapors of NOx, SOx, and POx.
Specification
Acetophenone, 4'-hydroxy-, O-(isopropylcarbamoyl)oxime, O-ester with O,O-diethyl phosphorothio , its cas register number is 22936-17-0. It also can be called Phosphorothioic acid, O,O-diethyl O-(4-(1-(((((1-methylethyl)amino)carbonyl)oxy)imino)ethyl)phenyl) ester .