predioxin

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Names

[ CAS No. ]:
53555-01-4

[ Name ]:
predioxin

[Synonym ]:
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

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


Related Compounds

  • 1-ethyl-N-(1,3-thiazol-5-ylmethyl)-1H-pyrazol-4-amine
  • 2-(Methylsulfanyl)-N-(1,3-thiazol-5-ylmethyl)aniline
  • 2-(3-amino-1H-1,2,4-triazol-1-yl)-N-(2-methoxyethyl)propanamide
  • 2-(Phenylthio)-N-(thiazol-5-ylmethyl)ethan-1-amine
  • Benzyl[(pyrimidin-5-yl)methyl]amine
  • 2-chloro-N-(pyrimidin-5-ylmethyl)aniline
  • 3-(N-Methyltetrahydro-2H-pyran-3-carboxamido)propanoic acid
  • 4-Bromo-3-methyl-N-(thiazol-5-ylmethyl)aniline
  • [(2-Chlorophenyl)methyl](1,3-thiazol-5-ylmethyl)amine
  • 3,5-dimethyl-N-(1,3-thiazol-5-ylmethyl)aniline
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