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1670-84-4

Basic Information
CAS No.: 1670-84-4
Name: Indole-2-carboxamide
Article Data: 36
Molecular Structure:
Molecular Structure of 1670-84-4 (Indole-2-carboxamide)
Formula: C9H8N2O
Molecular Weight: 160.175
Synonyms: 2-Carbamoylindole;Indole-2-carboxamide(6CI,7CI,8CI);
Density: 1.328 g/cm3
Melting Point: 234.5-235.5 °C
Boiling Point: 457.6 °C at 760 mmHg
Flash Point: 230.6 °C
PSA: 58.88000
LogP: 1.96710
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  • 1H-INDOLE-2-CARBOXAMIDE  CAS NO.1670-84-4

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Specification

The 1H-Indole-2-carboxamide is an organic compound with the formula C9H8N2O. The IUPAC name of this chemical is 1H-Indole-2-carboxamide. With the CAS registry number 1670-84-4, it is also named as Indole, 2-carboxamide-. The product's category is Amide. Besides, its molecular weight is 160.17262.

Physical properties about 1H-Indole-2-carboxamide are: (1)ACD/LogP: 1.62; (2)ACD/LogD (pH 5.5): 1.61; (3)ACD/LogD (pH 7.4): 1.61; (4)ACD/BCF (pH 5.5): 9.94; (5)ACD/BCF (pH 7.4): 9.94; (6)ACD/KOC (pH 5.5): 180.05; (7)ACD/KOC (pH 7.4): 180.05; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 25.24 Å2; (12)Index of Refraction: 1.716; (13)Molar Refractivity: 47.45 cm3; (14)Molar Volume: 120.5 cm3; (15)Polarizability: 18.81×10-24 cm3; (16)Surface Tension: 67.1 dyne/cm; (17)Density: 1.328 g/cm3; (18)Flash Point: 230.6 °C; (19)Enthalpy of Vaporization: 71.78 kJ/mol; (20)Boiling Point: 457.6 °C at 760 mmHg; (21)Vapour Pressure: 1.47E-08 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C9H8N2O/c10-9(12)8-5-6-3-1-2-4-7(6)11-8/h1-5,11H,(H2,10,12)
(2)InChIKey: VFHUJFBEFDVZPJ-UHFFFAOYAL
(3)Std. InChI: InChI=1S/C9H8N2O/c10-9(12)8-5-6-3-1-2-4-7(6)11-8/h1-5,11H,(H2,10,12)
(4)Std. InChIKey: VFHUJFBEFDVZPJ-UHFFFAOYSA-N