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56297-43-9

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Basic Information
CAS No.: 56297-43-9
Name: 1-Methyl-1H-indole-2-carboxamide
Article Data: 15
Molecular Structure:
Molecular Structure of 56297-43-9 (1-Methyl-1H-indole-2-carboxamide)
Formula: C10H10N2O
Molecular Weight: 174.1992
Synonyms: 1H-Indole-2-carboxamide, 1-methyl-;
Density: 1.24 g/cm3
Boiling Point: 422.9 °C at 760 mmHg
Flash Point: 209.6 °C
PSA: 48.02000
LogP: 1.97750
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Specification

This chemical's CAS registry number is 56297-43-9 and it also known as 1H-Indole-2-carboxamide, 1-methyl-. It belongs to the product category of Indoles and derivatives. This chemical's molecular formula is C10H10N2O and molecular weight is 174.1992. What's more, its systematic name is called 1-Methyl-1H-indole-2-carboxamide.

Physical properties about 1-Methyl-1H-indole-2-carboxamide are: (1)ACD/LogP: 1.06; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.06; (4)ACD/LogD (pH 7.4): 1.06; (5)ACD/BCF (pH 5.5): 3.78; (6)ACD/BCF (pH 7.4): 3.78; (7)ACD/KOC (pH 5.5): 90.13; (8)ACD/KOC (pH 7.4): 90.13; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 25.24 Å2; (13)Index of Refraction: 1.631; (14)Molar Refractivity: 50.06 cm3; (15)Molar Volume: 140.4 cm3; (16)Polarizability: 19.84×10-24 cm3; (17)Surface Tension: 48.2 dyne/cm; (18)Density: 1.24 g/cm3; (19)Flash Point: 209.6 °C; (20)Enthalpy of Vaporization: 67.71 kJ/mol; (21)Boiling Point: 422.9 °C at 760 mmHg; (22)Vapour Pressure: 2.33E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c2cc1ccccc1n2C)N
(2) InChI: InChI=1/C10H10N2O/c1-12-8-5-3-2-4-7(8)6-9(12)10(11)13/h2-6H,1H3,(H2,11,13)
(3) InChIKey: CYDRRUIHHLXFKW-UHFFFAOYAF