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1344-32-7

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Basic Information
CAS No.: 1344-32-7
Name: trichloro(chloromethyl)benzene
Molecular Structure:
Molecular Structure of 1344-32-7 (trichloro(chloromethyl)benzene)
Formula: C7H4Cl4
Molecular Weight: 229.91
Synonyms: trichloro(chloromethyl)benzene;TRICHLOROBENZYL CHLORIDE)
EINECS: 215-692-1
Density: 1.502 g/cm3
Boiling Point: 279.7 °C at 760 mmHg
Flash Point: 127.7 °C
Solubility: 2mg/L(25 oC)
PSA: 0.00000
LogP: 4.38560
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Consensus Reports

Reported in EPA TSCA Inventory.

Specification

The Trichlorobenzyl chloride, with the CAS registry number 1344-32-7, is also known as Toluene, alpha,ar,ar,ar-tetrachloro-. This chemical's molecular formula is C7H4Cl4 and molecular weight is 229.9187. Its systematic name is called 1,3,5-trichloro-2-(chloromethyl)benzene. This chemical's classification codes are Agricultural Chemical; Herbicide; Out-dated Pesticide.

Physical properties of Trichlorobenzyl chloride: (1)ACD/LogP: 4.31; (2)ACD/LogD (pH 5.5): 4.31; (3)ACD/LogD (pH 7.4): 4.31; (4)ACD/BCF (pH 5.5): 1109.36; (5)ACD/BCF (pH 7.4): 1109.36; (6)ACD/KOC (pH 5.5): 5263.37; (7)ACD/KOC (pH 7.4): 5263.37; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.577; (10)Molar Refractivity: 50.7 cm3; (11)Molar Volume: 152.9 cm3; (12)Surface Tension: 42.2 dyne/cm; (13)Density: 1.502 g/cm3; (14)Flash Point: 127.7 °C; (15)Enthalpy of Vaporization: 49.76 kJ/mol; (16)Boiling Point: 279.7 °C at 760 mmHg; (17)Vapour Pressure: 0.00671 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: ClCc1c(Cl)cc(Cl)cc1Cl
(2)InChI: InChI=1/C7H4Cl4/c8-3-5-6(10)1-4(9)2-7(5)11/h1-2H,3H2
(3)InChIKey: NJQRKFOZZUIMGW-UHFFFAOYAP

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 oral 3075mg/kg (3075mg/kg)   "Pesticide Index," Frear, E.H., ed., State College, PA, College Science Pub., 1969Vol. 4, Pg. 359, 1969.