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3-(4-Chlorophenyl)-4-(1-methyl-1H-indol-3-yl)-1H-pyrrole-2,5-dione (125313-99-7)

Identification
Name:3-(4-Chlorophenyl)-4-(1-methyl-1H-indol-3-yl)-1H-pyrrole-2,5-dione
CAS:125313-99-7
Molecular Formula: C19H13ClN2O2
Molecular Weight: 336.77
Molecular Structure: (C19H13ClN2O2)
Properties
Density:1.38
Specification:

This chemical is called 3-(4-Chlorophenyl)-4-(1-methyl-1H-indol-3-yl)-1H-pyrrole-2,5-dione. With the molecular formula of C19H13ClN2O2, its molecular weight is 336.77. The CAS registry number of this chemical is 125313-99-7.

Other characteristics of the 3-(4-Chlorophenyl)-4-(1-methyl-1H-indol-3-yl)-1H-pyrrole-2,5-dione can be summarised as followings: (1)ACD/LogP: 4.40; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.4; (4)ACD/LogD (pH 7.4): 4.19; (5)ACD/BCF (pH 5.5): 1291.07; (6)ACD/BCF (pH 7.4): 803.95; (7)ACD/KOC (pH 5.5): 5854.01; (8)ACD/KOC (pH 7.4): 3645.31; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 42.31 Å2; (13)Index of Refraction: 1.692; (14)Molar Refractivity: 93.04 cm3; (15)Molar Volume: 242.8 cm3; (16)Polarizability: 36.88×10-24cm3; (17)Surface Tension: 53 dyne/cm; (18)Density: 1.38 g/cm3; (19)Flash Point: 301 °C; (20)Enthalpy of Vaporization: 86.02 kJ/mol; (21)Boiling Point: 574.1 °C at 760 mmHg; (22)Vapour Pressure: 3.48E-13 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: Clc1ccc(cc1)C=4C(=O)NC(=O)C=4c3c2ccccc2n(c3)C
2.InChI: InChI=1/C19H13ClN2O2/c1-22-10-14(13-4-2-3-5-15(13)22)17-16(18(23)21-19(17)24)11-6-8-12(20)9-7-11/h2-10H,1H3,(H,21,23,24)
3.InChIKey: LGGVBRRKUKTEEO-UHFFFAOYAN

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