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Name |
Benzene,2-chloro-1,4-dinitro- |
EINECS | N/A |
CAS No. | 619-16-9 | Density | 1.619 g/cm3 |
PSA | 91.64000 | LogP | 3.20280 |
Solubility | N/A | Melting Point |
64 °C |
Formula | C6H3ClN2O4 | Boiling Point | 320.1 °C at 760 mmHg |
Molecular Weight | 202.554 | Flash Point | 147.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | Xn | |
Synonyms |
1,4-Dinitro-2-chlorobenzene;1-Chloro-2,5-dinitrobenzene;2,5-Dinitrochlorobenzene;2-Chloro-1,4-dinitrobenzene;NSC 154554; |
Article Data | 2 |
The Benzene, 2-chloro-1, 4-dinitro-, with the CAS registry number of 619-16-9, is also known as 1-Chloro-2, 5-dinitrobenzene and 1, 4-Dinitro-2-chlorobenzene. This chemical's molecular formula is C6H3ClN2O4 and molecular weight is 202.55202. What's more, its IUPAC name is 2-Chloro-1, 4-dinitrobenzene. Besides, this chemical may cause damage to health.
Physical properties about Benzene, 2-chloro-1, 4-dinitro- are: (1)ACD/LogP: 1.85; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.85; (4)ACD/LogD (pH 7.4): 1.85; (5)ACD/BCF (pH 5.5): 14.96; (6)ACD/BCF (pH 7.4): 14.96; (7)ACD/KOC (pH 5.5): 241.34; (8)ACD/KOC (pH 7.4): 241.34; (9)#H bond acceptors: 6; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 91.64 Å2; (13)Index of Refraction: 1.625; (14)Molar Refractivity: 44.23 cm3; (15)Molar Volume: 125 cm3; (16)Polarizability: 17.53×10-24 cm3; (17)Surface Tension: 64.2 dyne/cm; (18)Density: 1.619 g/cm3; (19)Flash Point: 147.4 °C; (20)Enthalpy of Vaporization: 53.94 kJ/mol; (21)Boiling Point: 320.1 °C at 760 mmHg; (22)Vapour Pressure: 0.000607 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=[N+]([O-])c1ccc(cc1Cl)[N+]([O-])=O
(2) InChI: InChI=1/C6H3ClN2O4/c7-5-3-4(8(10)11)1-2-6(5)9(12)13/h1-3H
(3) InChIKey: OEZJLUBWUDVTSS-UHFFFAOYAS