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CAS No.: | 18984-21-9 |
---|---|
Name: | 2,4-DICHLORO-OMEGA-NITROSTYRENE |
Article Data: | 23 |
Molecular Structure: | |
Formula: | C8H5Cl2NO2 |
Molecular Weight: | 218.039 |
Synonyms: | Styrene,2,4-dichloro-b-nitro-(7CI,8CI);2,4-Dichloro-1-(2-nitrovinyl)benzene;2,4-Dichloro-b-nitrostyrene;NSC 81882; |
Density: | 1.447 g/cm3 |
Melting Point: | 114-119 °C |
Boiling Point: | 334.1 °C at 760 mmHg |
Flash Point: | 155.9 °C |
Hazard Symbols: | Xn,N,Xi |
Risk Codes: | 22-36-50/53 |
Safety: | 26-36-60-61 |
PSA: | 45.82000 |
LogP: | 3.76400 |
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The Benzene,2,4-dichloro-1-(2-nitroethenyl)-, with the CAS registry number 18984-21-9, is also known as 1-((1E)-2-Nitrovinyl)-2,4-dichlorobenzene. It belongs to the product categories of Alkenyl; Halogenated Hydrocarbons; Organic Building Blocks. This chemical's molecular formula is C8H5Cl2NO2 and molecular weight is 218.04. What's more, both its IUPAC name and systematic name are the same which is called 2,4-Dichloro-1-[(E)-2-nitroethenyl]benzene.
Physical properties about Benzene,2,4-dichloro-1-(2-nitroethenyl)- are: (1) ACD/LogP: 3.06; (2) # of Rule of 5 Violations: 0; (3) #H bond acceptors: 3; (4) #H bond donors: 0; (5) #Freely Rotating Bonds: 2; (6) Polar Surface Area: 45.82 Å2; (7) Index of Refraction: 1.626; (8) Molar Refractivity: 53.32 cm3; (9)Molar Volume: 150.5 cm3; (10) Surface Tension: 50.1 dyne/cm; (11) Density: 1.447 g/cm3; (12) Flash Point: 155.9 °C; (13) Enthalpy of Vaporization: 55.42 kJ/mol; (14) Boiling Point: 334.1 °C at 760 mmHg; (15) Vapour Pressure: 0.000253 mmHg at 25 °C; (16) Melting Point: 114-119 °C.
Uses of Benzene,2,4-dichloro-1-(2-nitroethenyl)-: (1) it is used as the nucleic acid drugs intermediates, health food and biochemical reagents; (2) it is used to produce adenosine triphosphate, ring adenosine acid biochemical drugs.
When you are dealing with this chemical, you should be very careful. This chemical is irritating to eyes and harmful if swallowed. It may resent an immediate or delayed danger to one or more components of the environment and it may cause inflammation to the skin or other mucous membranes. In addition, it is very toxic to aquatic organisms and it may cause long-term adverse effects in the aquatic environment. Therefore, you should wear suitable protective clothing and avoid releasing to the environment. This material and its container must be disposed of as hazardous waste. In case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: Clc1cc(Cl)ccc1/C=C/[N+]([O-])=O
(2) InChI: InChI=1/C8H5Cl2NO2/c9-7-2-1-6(8(10)5-7)3-4-11(12)13/h1-5H/b4-3+
(3) InChIKey: LIWIJBBAMBDXME-ONEGZZNKBZ