1,1,1-Trichloro-2,2-di(2,4-xylyl)ethane

Modify Date: 2025-11-25 12:47:58

1,1,1-Trichloro-2,2-di(2,4-xylyl)ethane Structure
1,1,1-Trichloro-2,2-di(2,4-xylyl)ethane structure
Common Name 1,1,1-Trichloro-2,2-di(2,4-xylyl)ethane
CAS Number 5810-86-6 Molecular Weight 341.70200
Density 1.197g/cm3 Boiling Point 422.4ºC at 760 mmHg
Molecular Formula C18H19Cl3 Melting Point N/A
MSDS N/A Flash Point 298ºC

 Names

Name 2,4-dimethyl-1-[2,2,2-trichloro-1-(2,4-dimethylphenyl)ethyl]benzene

 Chemical & Physical Properties

Density 1.197g/cm3
Boiling Point 422.4ºC at 760 mmHg
Molecular Formula C18H19Cl3
Molecular Weight 341.70200
Flash Point 298ºC
Exact Mass 340.05500
LogP 6.42230
Index of Refraction 1.572
InChIKey SYIOCCMYRHBPIF-UHFFFAOYSA-N
SMILES Cc1ccc(C(c2ccc(C)cc2C)C(Cl)(Cl)Cl)c(C)c1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KH6400000
CHEMICAL NAME :
Ethane, 1,1-bis(2,4-xylyl)-2,2,2-trichloro-
CAS REGISTRY NUMBER :
5810-86-6
BEILSTEIN REFERENCE NO. :
2134277
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H19-Cl3
MOLECULAR WEIGHT :
341.72
WISWESSER LINE NOTATION :
GXGGYR B1 D1&R B1 D1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
9800 mg/kg
TOXIC EFFECTS :
Behavioral - convulsions or effect on seizure threshold
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 73,128,1946

 Synthetic Route

~%

1,1,1-Trichloro-2,2-di(2,4-xylyl)ethane Structure

1,1,1-Trichloro...

CAS#:5810-86-6

Literature: Brand; Busse-Sundermann Chemische Berichte, 1942 , vol. 75, p. 1819,1825
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