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

  • Methyl 6-(aminomethyl)-2-ethylpyridine-3-carboxylate
  • Methyl 6-(aminomethyl)-2-(propan-2-yl)pyridine-3-carboxylate
  • Methyl 6-(aminomethyl)-2-propylpyridine-3-carboxylate
  • 3-(5-Methoxypiperidin-3-yl)propanoic acid
  • 3-(5-Propoxypiperidin-3-yl)propanoic acid
  • 2-Bromo-1-(3,4-difluorophenyl)-2-methylpropan-1-one
  • tert-butyl N-[2-(prop-2-yn-1-ylsulfanyl)ethyl]carbamate
  • 2-(Benzylamino)-1-[2-(trifluoromethyl)phenyl]ethan-1-ol
  • 1-[(Acetylsulfanyl)methyl]cyclopentane-1-carbonitrile
  • N-methyl-N-(pyrrolidin-3-ylmethyl)-1H-benzo[d]imidazol-2-amine hydrochloride
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