- Carbamodithioic acid, N,N-diethyl-, phenylmethylester
- Carbamodithioic acid,(hydroxymethyl)methyl-, monopotassium salt (9CI)
- Carbamodithioic acid,ethyl ester
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- Carbamodithioic acid,N,N-bis(phenylmethyl)-, sodium salt (1:1)
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- Carbamodithioicacid, methylphenyl-, ammonium salt (9CI)
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Cas Database |
| Name |
Carbamodithioic acid, N,N-diethyl-, phenylmethylester |
EINECS | N/A |
| CAS No. | 3052-61-7 | Density | 1.116 g/cm3 |
| PSA | 60.63000 | LogP | 3.54650 |
| Solubility | N/A | Melting Point |
N/A |
| Formula | C12H17NS2 | Boiling Point | 331.7 °C at 760 mmHg |
| Molecular Weight | 239.406 | Flash Point | 154.4 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Carbamic acid, diethyldithio-,benzyl ester (6CI,7CI,8CI);Carbamodithioic acid,diethyl-, phenylmethyl ester (9CI);Benzyl N,N-diethyldithiocarbamate;Benzyl diethyldithiocarbamate;Cabac;S-Benzyl N,N-diethyldithiocarbamate; |
Article Data | 11 |
Carbamodithioic acid, N,N-diethyl-, phenylmethylester Specification
The Carbamodithioic acid, N,N-diethyl-, phenylmethylester, with the CAS registry number 3052-61-7, is also known as Benzyl N,N-diethyldithiocarbamate. This chemical's molecular formula is C12H17NS2 and molecular weight is 239.4001. Its systematic name is called benzyl diethylcarbamodithioate.
Physical properties of Carbamodithioic acid, N,N-diethyl-, phenylmethylester: (1)ACD/LogP: 4.14; (2)ACD/LogD (pH 5.5): 4.14; (3)ACD/LogD (pH 7.4): 4.14; (4)ACD/BCF (pH 5.5): 823.77; (5)ACD/BCF (pH 7.4): 823.79; (6)ACD/KOC (pH 5.5): 4253.36; (7)ACD/KOC (pH 7.4): 4253.47; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 5; (10)Index of Refraction: 1.599; (11)Molar Refractivity: 73.34 cm3; (12)Molar Volume: 214.4 cm3; (13)Surface Tension: 48.4 dyne/cm; (14)Density: 1.116 g/cm3; (15)Flash Point: 154.4 °C; (16)Enthalpy of Vaporization: 57.44 kJ/mol; (17)Boiling Point: 331.7 °C at 760 mmHg; (18)Vapour Pressure: 0.000153 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: S=C(SCc1ccccc1)N(CC)CC
(2)InChI: InChI=1/C12H17NS2/c1-3-13(4-2)12(14)15-10-11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3
(3)InChIKey: SNBMGLUIIGFNFE-UHFFFAOYAZ
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