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| Name |
Phosphorothioic acid, O-ethyl S-(p-tolyl) ester |
EINECS | N/A |
| CAS No. | 63980-89-2 | Density | 1.26g/cm3 |
| PSA | 81.64000 | LogP | 3.22400 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C9H13 O3 P S | Boiling Point | 361.1°C at 760 mmHg |
| Molecular Weight | 232.25 | Flash Point | 172.2°C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Poison by ingestion. When heated to decomposition it emits very toxic fumes of POx and SOx. See also ESTERS. | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
N/A |
Phosphorothioic acid, O-ethyl S-(p-tolyl) ester Chemical Properties
Product Name: Phosphorothioic acid, O-ethyl S-(p-tolyl) ester (CAS NO.63980-89-2)
Molecular Formula: C9H13O3PS
Molecular Weight: 232.25g/mol
Mol File: 63980-89-2.mol
Boiling point: 361.1 °C at 760 mmHg
Flash Point: 172.2 °C
Density: 1.26 g/cm3
Surface Tension: 48.7 dyne/cm
Enthalpy of Vaporization: 64.03 kJ/mol
Vapour Pressure: 7.61E-06 mmHg at 25°C
XLogP3-AA: 1.7
H-Bond Donor: 1
H-Bond Acceptor: 3
Structure Descriptors of Phosphorothioic acid, O-ethyl S-(p-tolyl) ester (CAS NO.63980-89-2):
IUPAC Name: ethoxy-(4-methylphenyl)sulfanylphosphinic acid
Canonical SMILES: CCOP(=O)(O)SC1=CC=C(C=C1)C
InChI: InChI=1S/C9H13O3PS/c1-3-12-13(10,11)14-9-6-4-8(2)5-7-9/h4-7H,3H2,1-2H3,(H,10,11)
InChIKey: PPAVHHVBWSUYDY-UHFFFAOYSA-N
Phosphorothioic acid, O-ethyl S-(p-tolyl) ester Toxicity Data With Reference
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| bird - wild | LD50 | oral | 1600ug/kg (1.6mg/kg) | Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972. | |
| rat | LD50 | oral | 50mg/kg (50mg/kg) | Toxicology and Applied Pharmacology. Vol. 21, Pg. 315, 1972. |
Phosphorothioic acid, O-ethyl S-(p-tolyl) ester Safety Profile
Poison by ingestion. When heated to decomposition it emits very toxic fumes of POx and SOx. See also ESTERS.
Phosphorothioic acid, O-ethyl S-(p-tolyl) ester Specification
Phosphorothioic acid, O-ethyl S-(p-tolyl) ester ,its CAS NO. is 63980-89-2,the synonyms is O-Ethyl S-(p-tolyl) phosphorothioate ; Phosphorothioic acid, O-ethyl S-(4-methylphenyl) ester (9CI) .
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