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Basic Information
CAS No.: 663177-70-6
Name: 2-Cyclopropyl-4-nitro-1H-indole
Molecular Structure:
Molecular Structure of 663177-70-6 (2-Cyclopropyl-4-nitro-1H-indole)
Formula: C11H10N2O2
Molecular Weight: 202.21
Synonyms: 1H-Indole,2-cyclopropyl-4-nitro;
Density: 1.426 g/cm3
Boiling Point: 419.2 °C at 760 mmHg
Flash Point: 207.3 °C
PSA: 61.61000
LogP: 3.47670
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Specification

The 2-Cyclopropyl-4-nitro-1H-indole is the organic compound with the formula C11H10N2O2. With the CAS registry number 663177-70-6, its IUPAC name is 2-cyclopropyl-4-nitro-1H-indole.

Physical properties of 2-Cyclopropyl-4-nitro-1H-indole: (1)ACD/LogP: 2.92; (2)ACD/LogD (pH 5.5): 2.92; (3)ACD/LogD (pH 7.4): 2.92; (4)ACD/BCF (pH 5.5): 98.26; (5)ACD/BCF (pH 7.4): 98.26; (6)ACD/KOC (pH 5.5): 928.45; (7)ACD/KOC (pH 7.4): 928.45; (8)#H bond acceptors: 4; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.739; (12)Molar Refractivity: 57.1 cm3; (13)Molar Volume: 141.7 cm3; (14)Surface Tension: 71.7 dyne/cm; (15)Density: 1.426 g/cm3; (16)Flash Point: 207.3 °C; (17)Enthalpy of Vaporization: 64.68 kJ/mol; (18)Boiling Point: 419.2 °C at 760 mmHg; (19)Vapour Pressure: 7.53E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CC1C2=CC3=C(N2)C=CC=C3[N+](=O)[O-]
(2)InChI: InChI=1S/C11H10N2O2/c14-13(15)11-3-1-2-9-8(11)6-10(12-9)7-4-5-7/h1-3,6-7,12H,4-5H2
(3)InChIKey: HSJVJOCVBCVOIX-UHFFFAOYSA-N