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CAS No.: | 25641-99-0 |
---|---|
Name: | 1,2-bis(dichloromethyl)benzene |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C8H6Cl4 |
Molecular Weight: | 243.948 |
Synonyms: | o-Xylene, a,a,a',a'-tetrachloro- (8CI);a,a,a',a'-Tetrachloro-o-xylene; |
EINECS: | 247-159-4 |
Density: | 1.443 g/cm3 |
Melting Point: | 85°C |
Boiling Point: | 294.567 °C at 760 mmHg |
Flash Point: | 134.25 °C |
Appearance: | White to Grey white crystals powder |
Hazard Symbols: | C |
Risk Codes: | 34-36/37/38 |
Safety: | 26-36/37/39-45 |
Transport Information: | UN 1759 |
PSA: | 0.00000 |
LogP: | 4.63900 |
o-phthalic dicarboxaldehyde
α,α,α',α'-tetrachloro-o-xylene
Conditions | Yield |
---|---|
With tungsten(VI) chloride In dichloromethane for 5h; Heating; | 90% |
o-xylene
α,α,α',α'-tetrachloro-o-xylene
Conditions | Yield |
---|---|
With chlorine at 140℃; spaeter bei 160-170grad; | |
With phosphorus pentachloride at 170 - 200℃; |
Conditions | Yield |
---|---|
at 140 - 160℃; Einleiten von Chlor; | |
at 142 - 160℃; Einleiten von Chlor; |
o-xylene
chlorine
A
α,α,α',α'-tetrachloro-o-xylene
B
α,α,α'-trichloro-o-xylene
Conditions | Yield |
---|---|
at 140 - 160℃; |
α,α,α',α'-tetrachloro-o-xylene
o-dichloromethyltrichloromethylbenzene
Conditions | Yield |
---|---|
With chlorine In tetrachloromethane for 24h; Heating; Irradiation; | 12.5% |
α,α,α',α'-tetrachloro-o-xylene
triphenylphosphine
1,2-bis((diphenylphosphino)methyl)benzene
Conditions | Yield |
---|---|
With ammonia; sodium; ammonium chloride 1) 30 min., 2) 2 h; Yield given. Multistep reaction; |
α,α,α',α'-tetrachloro-o-xylene
PHTHALAZINE
Conditions | Yield |
---|---|
at 150℃; |
Conditions | Yield |
---|---|
at 200 - 210℃; |
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This chemical is called Benzene, 1,2-bis(dichloromethyl)-, and its systematic name is 1,2-bis(dichloromethyl)benzene. With the molecular formula of C8H6Cl4, its molecular weight is 243.95. The CAS registry number of this chemical is 25641-99-0. Additionally, its product category is Industrial/Fine Chemicals.
Other characteristics of the Benzene, 1,2-bis(dichloromethyl)- can be summarised as followings: (1)ACD/LogP: 3.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.04; (4)ACD/LogD (pH 7.4): 3.04; (5)ACD/BCF (pH 5.5): 119.43; (6)ACD/BCF (pH 7.4): 119.43; (7)ACD/KOC (pH 5.5): 1067.57; (8)ACD/KOC (pH 7.4): 1067.57; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.57; (14)Molar Refractivity: 55.48 cm3; (15)Molar Volume: 169 cm3; (16)Polarizability: 21.99×10-24cm3; (17)Surface Tension: 42.6 dyne/cm; (18)Density: 1.442 g/cm3; (19)Flash Point: 134.2 °C; (20)Enthalpy of Vaporization: 51.28 kJ/mol; (21)Boiling Point: 294.6 °C at 760 mmHg; (22)Vapour Pressure: 0.00283 mmHg at 25°C.
Production method of this chemical: The Benzene, 1,2-bis(dichloromethyl)- could be obtained by the reactant of benzene-1,2-dicarbaldehyde. This reaction needs the reagent of WCl6, and the solvent of CH2Cl2. The yield is 90 %. In addition, this reaction should be taken for 5 hours. The other condition is heating.
When you are using this chemical, please be cautious about it as the following: This chemical, causes burns, is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: ClC(Cl)c1ccccc1C(Cl)Cl
2.InChI: InChI=1/C8H6Cl4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4,7-8H
3.InChIKey: UFJYKWQUTDGGPV-UHFFFAOYAP