1H-Indole-5-carbonitrile,2,3-dihydro- supplier

Name
5-CYANO-2,3-DIHYDRO-1H-INDOLE
EINECS
CAS No. 15861-23-1
Article Data11
CAS DataBase
Density 1.189 g/cm³
Solubility
Melting Point
Formula C₉H₈N₂
Boiling Point 304.421 °C at 760 mmHg
Molecular Weight 144.176
Flash Point 137.909 °C
Transport Information
Appearance
Safety 24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Indolinecarbonitrile(8CI);2,3-Dihydro-1H-indole-5-carbonitrile;5-Cyanoindoline;
PSA 35.82000
LogP 1.66428

1H-Indole-5-carbonitrile,2,3-dihydro- Specification

The 1H-Indole-5-carbonitrile,2,3-dihydro- is an organic compound with the formula C₉H₈N₂. The systematic name of this chemical is 2,3-Dihydro-1H-indole-5-carbonitrile. With the CAS registry number 15861-23-1, it is also named as Indoline-5-carbonitrile. Besides, its molecular weight is 144.17.

Physical properties about 1H-Indole-5-carbonitrile,2,3-dihydro- are: (1)ACD/LogP: 0.40; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 9; (5)ACD/BCF (pH 7.4): 9; (6)ACD/KOC (pH 5.5): 167; (7)ACD/KOC (pH 7.4): 167; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)Polar Surface Area: 35.82 Å²; (11)Index of Refraction: 1.612; (12)Molar Refractivity: 42.179 cm³; (13)Molar Volume: 121.281 cm³; (14)Polarizability: 16.721×10^-24 cm³; (15)Surface Tension: 53.73 dyne/cm; (16)Density: 1.189 g/cm³; (17)Flash Point: 137.909 °C; (18)Enthalpy of Vaporization: 54.479 kJ/mol; (19)Boiling Point: 304.421 °C at 760 mmHg; (20)Vapour Pressure: 0.001 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C9H8N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-2,5,11H,3-4H2
(2)InChIKey: KBNWGVBBEPQFIZ-UHFFFAOYAX
(3)Std. InChI: InChI=1S/C9H8N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-2,5,11H,3-4H2
(4)Std. InChIKey: KBNWGVBBEPQFIZ-UHFFFAOYSA-N

Product Name

5-CYANO-2,3-DIHYDRO-1H-INDOLE

1H-Indole-5-carbonitrile,2,3-dihydro- Specification

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