-
Name
Phenyldithiocarbamic acid methyl ester
- EINECS
- CAS No. 701-73-5
- Article Data17
- CAS DataBase
- Density 1.269g/cm3
- Solubility
- Melting Point 95.5°C
- Formula C8H9NS2
- Boiling Point 277.2°C at 760 mmHg
- Molecular Weight 183.298
- Flash Point 121.5°C
- Transport Information
- Appearance
- Safety Poison by intravenous route. When heated to decomposition it emits very toxic fumes of NOx and SOx. See also CARBAMATES.
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms N-phenyl-S-methyldithiocarbamate;methyl phenylcarbamodithioate;CARBANILIC ACID,DITHIO-,METHYL ESTER;Carbamodithioic acid,phenyl-,methyl ester;PhNH-CS-SMe;S-methyl phenylthiocarbamate;Methyl dithiocarbanilate;Methyl phenyldithiocarbamate;Methyl N-phenyldithiocarbamate;
- PSA 69.42000
- LogP 2.81940
Methyl dithiocarbanilate Chemical Properties
The Molecular Structure of Methyl dithiocarbanilate (CAS NO.701-73-5):
Molecular Formula: C8H9NS2
Molecular Weight: 183.293760 g/mol
IUPAC: methyl N-phenylcarbamodithioate
Density: 1.269 g/cm3
Flash Point: 121.5 °C
Enthalpy of Vaporization: 51.58 kJ/mol
Boiling Point: 277.2 °C at 760 mmHg
Vapour Pressure: 0.00458 mmHg at 25°C
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 2.66
ACD/LogD (pH 7.4): 2.66
ACD/BCF (pH 5.5): 61.65
ACD/BCF (pH 7.4): 61.63
ACD/KOC (pH 5.5): 665.01
ACD/KOC (pH 7.4): 664.88
Polar Surface Area: 60.63Å2
Index of Refraction: 1.699
Molar Refractivity: 55.78 cm3
Molar Volume: 144.3 cm3
Surface Tension: 60.8 dyne/cm
Methyl dithiocarbanilate Toxicity Data With Reference
| 1. | ivn-mus LD50:180 mg/kg | CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) NX#04529 . |
Methyl dithiocarbanilate Safety Profile
Poison by intravenous route. When heated to decomposition it emits very toxic fumes of NOx and SOx. See also CARBAMATES.
Methyl dithiocarbanilate Specification
Methyl dithiocarbanilate (CAS NO.701-73-5) is also called as 4-12-00-00835 (Beilstein Handbook Reference) ; AI3-31472 ; BRN 2803060 ; ENT 31472 ; Methyl N-phenyldithiocarbamate ; Methyl phenylcarbamodithioate ; Methyl phenyldithiocarbamate ; NSC 57602 ; Carbamodithioic acid, phenyl-, methyl ester (9CI) ; Carbanilic acid, dithio-, methyl ester .
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