Benzenamine,2,4-dinitro-N-(2-nitrophenyl)- supplier

Name
2,4-dinitro-N-(2-nitrophenyl)aniline
EINECS 238-406-7
CAS No. 14434-10-7
Density 1.592 g/cm³
Solubility
Melting Point
Formula C₁₂H₈N₄O₆
Boiling Point 463 °C at 760 mmHg
Molecular Weight 304.219
Flash Point 233.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Diphenylamine,2,2',4-trinitro- (7CI,8CI);2,2',4-Trinitrodiphenylamine;2,4,6'-Trinitrodiphenylamine;NSC 406142;2,4-Dinitro-N-(2-nitrophenyl)aniline;
PSA 149.49000
LogP 4.79740

Benzenamine,2,4-dinitro-N-(2-nitrophenyl)- Specification

The Benzenamine,2,4-dinitro-N-(2-nitrophenyl)-, with the CAS registry number 14434-10-7, is also known as 2,4,6'-Trinitrodiphenylamine. Its EINECS number is 238-406-7. This chemical's molecular formula is C₁₂H₈N₄O₆ and molecular weight is 304.22. What's more, its systematic name is 2,4-dinitro-N-(2-nitrophenyl)aniline.

Physical properties of Benzenamine,2,4-dinitro-N-(2-nitrophenyl)- are: (1)ACD/LogP: 4.54; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 4.54; (4)ACD/LogD (pH 7.4): 4.54; (5)ACD/BCF (pH 5.5): 1653.51; (6)ACD/BCF (pH 7.4): 1653.51; (7)ACD/KOC (pH 5.5): 7003.8; (8)ACD/KOC (pH 7.4): 7003.8; (9)#H bond acceptors: 10; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 140.7 Å²; (13)Index of Refraction: 1.717; (14)Molar Refractivity: 75.26 cm³; (15)Molar Volume: 190.9 cm³; (16)Polarizability: 29.83×10^-24cm³; (17)Surface Tension: 77.6 dyne/cm; (18)Density: 1.592 g/cm³; (19)Flash Point: 233.8 °C; (20)Enthalpy of Vaporization: 72.42 kJ/mol; (21)Boiling Point: 463 °C at 760 mmHg; (22)Vapour Pressure: 9.42E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC=C(C(=C1)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]
(2)InChI: InChI=1S/C12H8N4O6/c17-14(18)8-5-6-10(12(7-8)16(21)22)13-9-3-1-2-4-11(9)15(19)20/h1-7,13H
(3)InChIKey: RHTGPRLQFAYVBM-UHFFFAOYSA-N

Product Name

2,4-dinitro-N-(2-nitrophenyl)aniline

Benzenamine,2,4-dinitro-N-(2-nitrophenyl)- Specification

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