1H-Indole, 4-nitro-2-phenyl- supplier

Name
4-Nitro-2-phenylindole
EINECS
CAS No. 7746-36-3
Article Data4
CAS DataBase
Density 1.33 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₀N₂O₂
Boiling Point 477.5 °C at 760 mmHg
Molecular Weight 238.24
Flash Point 242.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 4-Nitro-2-phenyl-1H-indole;4-Nitro-2-phenylindole;Indole,4-nitro-2-phenyl- (7CI,8CI);
PSA 61.61000
LogP 4.26630

1H-Indole, 4-nitro-2-phenyl- Specification

This chemical is called 1H-Indole, 4-nitro-2-phenyl-, and its systematic name is 4-nitro-2-phenyl-1H-indole. With the molecular formula of C₁₄H₁₀N₂O₂, its molecular weight is 238.24. The CAS registry number of this chemical is 7746-36-3.

Other characteristics of the 1H-Indole, 4-nitro-2-phenyl- can be summarised as followings: (1)ACD/LogP: 4.41; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.41; (4)ACD/LogD (pH 7.4): 4.41; (5)ACD/BCF (pH 5.5): 1313.24; (6)ACD/BCF (pH 7.4): 1313.24; (7)ACD/KOC (pH 5.5): 5938.96; (8)ACD/KOC (pH 7.4): 5938.96; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 61.61 Å²; (13)Index of Refraction: 1.706; (14)Molar Refractivity: 69.66 cm³; (15)Molar Volume: 178.9 cm³; (16)Polarizability: 27.61×10^-24cm³; (17)Surface Tension: 60.6 dyne/cm; (18)Density: 1.33 g/cm³; (19)Flash Point: 242.6 °C; (20)Enthalpy of Vaporization: 71.31 kJ/mol; (21)Boiling Point: 477.5 °C at 760 mmHg; (22)Vapour Pressure: 8.08E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: [O-][N+](=O)c1cccc2nc(cc12)c3ccccc3
2.InChI: InChI=1/C14H10N2O2/c17-16(18)14-8-4-7-12-11(14)9-13(15-12)10-5-2-1-3-6-10/h1-9,15H
3.InChIKey: PQDVHCLDYBFYSR-UHFFFAOYAI

Product Name

4-Nitro-2-phenylindole

1H-Indole, 4-nitro-2-phenyl- Specification

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