predioxin

Modify Date: 2024-01-13 12:56:27

predioxin Structure
predioxin structure
Common Name predioxin
CAS Number 53555-01-4 Molecular Weight 358.43200
Density 1.642g/cm3 Boiling Point 384.3ºC at 760 mmHg
Molecular Formula C12H5Cl5O2 Melting Point N/A
MSDS N/A Flash Point 186.2ºC

 Names

Name 2,3,4-Trichloro-6-(2,4-dichlorophenoxy)phenol
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.642g/cm3
Boiling Point 384.3ºC at 760 mmHg
Molecular Formula C12H5Cl5O2
Molecular Weight 358.43200
Flash Point 186.2ºC
Exact Mass 355.87300
PSA 29.46000
LogP 6.45150
Index of Refraction 1.644

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SL0532000
CHEMICAL NAME :
Phenol, 2-(2,4-dichlorophenoxy)-4,5,6-trichloro-
CAS REGISTRY NUMBER :
53555-01-4
LAST UPDATED :
199612
DATA ITEMS CITED :
7
MOLECULAR FORMULA :
C12-H5-Cl5-O2
MOLECULAR WEIGHT :
358.42
WISWESSER LINE NOTATION :
QR BG CG DG FOR BG DG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
170 mg/kg
TOXIC EFFECTS :
Behavioral - somnolence (general depressed activity) Behavioral - irritability

MUTATION DATA

TEST SYSTEM :
Rodent - mouse
DOSE/DURATION :
50 mg/kg
REFERENCE :
EVSRBT Environmental Science Research. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) V.1- 1972- Volume(issue)/page/year: 12,325,1978

 Synthetic Route

~55%

predioxin Structure

predioxin

CAS#:53555-01-4

Literature: Humppi Synthesis, 1985 , vol. NO. 10, p. 919 - 924

 Synonyms

2-(2,4-dichloro-phenoxy)-4,5,6-trichloro-phenol
(-)-2-(2,4-Dichlorophenoxy)-1-imidazol-1-yl)-4,4-dimethyl-3-pentanone
4,5,6-trichloro-2-(2,4-dichlorophenoxy)phenol
Valconazole
2-(2,4-dichlorophenoxy)-1-imidazolyl-(1)-4,4-dimethyl-pentan-3-one
(R,S)-2-(2,4-Dichlorphenoxy)-1-imidazolyl-4,4-dimethyl-3-pentanon
2-(2,4-dichloro-phenoxy)-1-imidazol-1-yl-4,4-dimethyl-pentan-3-one
Valconazolum