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133-14-2

Basic Information
CAS No.: 133-14-2
Name: 2,4-Dichlorobenzoyl peroxide
Molecular Structure:
Molecular Structure of 133-14-2 (2,4-Dichlorobenzoyl peroxide)
Formula: C14H6Cl4O4
Molecular Weight: 380.011
Synonyms: 2,4-Dichlorobenzoylperoxide;2,4-Dichlorobibenzoyl peroxide;Bis(2,4-dichlorobenzoyl) peroxide;C 2 (crosslinking agent);Cadox TDP;Cadox TS;Cadox TS 50;Chaloxyd DCLBP50PSI;Elastosil AUX Crosslinker E;Elastosil AUX-E;Perkadox PD 50S;Siloprene CL 40;TC 2;TC 2 (peroxide);o,o',p,p'-Tetrachlorodibenzoyl peroxide;Vulcanizing agent DCBP;
EINECS: 205-094-9
Density: 1.577 g/cm3
Melting Point: 55 °C (dec.)
Boiling Point: 487.2 °C at 760 mmHg
Flash Point: 194.1 °C
Solubility: 29.93μg/L at 25℃
Appearance: white paste
Safety: 15-17
Transport Information: UN 3106
PSA: 52.60000
LogP: 5.22900
Synthetic route
89-75-8

2,4-dichlorobenzoyl chloride

133-14-2

bis(2,4-dichlorobenzoyl)-peroxide

Conditions
ConditionsYield
With (2S)-N-methyl-1-phenylpropan-2-amine hydrate; sodium peroxide; acetone
609-65-4

o-chlorobenzoyl chloride

89-75-8

2,4-dichlorobenzoyl chloride

A

133-14-2

bis(2,4-dichlorobenzoyl)-peroxide

B

1198794-83-0

2-chlorobenzoyl 2,4-dichlorobenzoyl peroxide

Conditions
ConditionsYield
With dihydrogen peroxide; sodium hydroxide In water at 20℃; for 0.5h; Product distribution / selectivity;
119072-55-8, 7188-38-7

tert-butylisonitrile

133-14-2

bis(2,4-dichlorobenzoyl)-peroxide

61176-08-7

N-(tert-butyl)-2,4-dichlorobenzamide

Conditions
ConditionsYield
With tetra-(n-butyl)ammonium iodide In water at 120℃; for 12h; Sealed tube;78%
133-14-2

bis(2,4-dichlorobenzoyl)-peroxide

2437-79-8

2,2',4,4'-Tetrachlorobiphenyl

Conditions
ConditionsYield
Thermolysis.im Vakuum;
133-14-2

bis(2,4-dichlorobenzoyl)-peroxide

A

50-84-0

2,4 dichlorobenzoic acid

B

15719-64-9, 15719-76-3, 97762-63-5

methylammonium carbonate

C

2.4.2'.4'-tetrachloro-diphenyl

2.4.2'.4'-tetrachloro-diphenyl

Conditions
ConditionsYield
im Vakuum;
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Consensus Reports

Reported in EPA TSCA Inventory.

Standards and Recommendations

DOT Classification:  Forbidden

Specification

The Bis(2,4-dichlorobenzoyl) peroxide, with the CAS registry number 133-14-2, is also known as Cadox TDP. Its EINECS registry number is 205-094-9. This chemical's molecular formula is C14H6Cl4O4 and molecular weight is 380.00704. Its IUPAC name is called (2,4-dichlorobenzoyl) 2,4-dichlorobenzenecarboperoxoate. When you are using this chemical, please be cautious about it. You should keep it away from heat and combustible material. What's more, this chemical is appropriate for open vulcanization of silicon rubber.

Physical properties of Bis(2,4-dichlorobenzoyl) peroxide: (1)ACD/LogP: 5.37; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.37; (4)ACD/LogD (pH 7.4): 5.37; (5)ACD/BCF (pH 5.5): 7126.33; (6)ACD/BCF (pH 7.4): 7126.33; (7)ACD/KOC (pH 5.5): 19928.39; (8)ACD/KOC (pH 7.4): 19928.39; (9)#H bond acceptors: 4; (10)#Freely Rotating Bonds: 5; (11)Index of Refraction: 1.617; (12)Molar Refractivity: 84.31 cm3; (13)Molar Volume: 240.9 cm3; (14)Surface Tension: 54.9 dyne/cm; (15)Density: 1.577 g/cm3; (16)Flash Point: 194.1 °C; (17)Enthalpy of Vaporization: 75.31 kJ/mol; (18)Boiling Point: 487.2 °C at 760 mmHg; (19)Vapour Pressure: 1.21E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC(=C(C=C1Cl)Cl)C(=O)OOC(=O)C2=C(C=C(C=C2)Cl)Cl
(2)InChI: InChI=1S/C14H6Cl4O4/c15-7-1-3-9(11(17)5-7)13(19)21-22-14(20)10-4-2-8(16)6-12(10)18/h1-6H
(3)InChIKey: WRXCBRHBHGNNQA-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 225mg/kg (225mg/kg)   International Polymer Science and Technology. Vol. 3, Pg. 93, 1976.