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Cas Database |
| Name |
1H-Indole-2,3-dione,5-chloro-1-methyl- |
EINECS | 262-231-5 |
| CAS No. | 60434-13-1 | Density | 1.454 g/cm3 |
| PSA | 37.38000 | LogP | 1.56410 |
| Solubility | N/A | Melting Point |
175.0 to 179.0 °C |
| Formula | C9H6ClNO2 | Boiling Point | 344.9 °C at 760 mmHg |
| Molecular Weight | 195.605 | Flash Point | 162.4 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes | N/A | |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
1-Methyl-5-chloro-2,3-indoledione;1-Methyl-5-chloroisatin;5-Chloro-1-methylisatin; |
Article Data | 104 |
1H-Indole-2,3-dione,5-chloro-1-methyl- Specification
The CAS registry number of 1H-Indole-2,3-dione,5-chloro-1-methyl- is 60434-13-1. Its EINECS registry number is 262-231-5. This chemical's molecular formula is C9H6ClNO2 and molecular weight is 195.60244. Its systematic name is called 5-chloro-1-methyl-1H-indole-2,3-dione.
Physical properties of 1H-Indole-2,3-dione,5-chloro-1-methyl-: (1)ACD/LogP: 1.18; (2)ACD/LogD (pH 5.5): 1.18; (3)ACD/LogD (pH 7.4): 1.18; (4)ACD/BCF (pH 5.5): 4.6; (5)ACD/BCF (pH 7.4): 4.6; (6)ACD/KOC (pH 5.5): 103.81; (7)ACD/KOC (pH 7.4): 103.81; (8)#H bond acceptors: 3; (9)Index of Refraction: 1.619; (10)Molar Refractivity: 47.24 cm3; (11)Molar Volume: 134.5 cm3; (12)Surface Tension: 54.9 dyne/cm; (13)Density: 1.454 g/cm3; (14)Flash Point: 162.4 °C; (15)Enthalpy of Vaporization: 58.89 kJ/mol; (16)Boiling Point: 344.9 °C at 760 mmHg; (17)Vapour Pressure: 6.39E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc2c(cc1)N(C(=O)C2=O)C
(2)InChI: InChI=1/C9H6ClNO2/c1-11-7-3-2-5(10)4-6(7)8(12)9(11)13/h2-4H,1H3
(3)InChIKey: NJOPQQPDPYWFFA-UHFFFAOYAP
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