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

Click to get detail synthetic route

Related Compounds

  • 6-Methyl-2-[(pyridin-3-yl)methyl]-2,3,5,6,7,8-hexahydrocinnolin-3-one
  • N-(4-chlorophenyl)-2-{[2-(3-methylphenyl)-5-phenyl-1H-imidazol-4-yl]sulfonyl}acetamide
  • N-(3,4-dimethylphenyl)-2-{[5-(2-fluorophenyl)-6-oxo-8-oxa-3,5-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),3,10,12-pentaen-4-yl]sulfanyl}acetamide
  • 12-(Benzenesulfonyl)-4-chloro-9,10-dimethyl-8-oxa-10-azatricyclo[7.3.1.0^{2,7}]trideca-2,4,6-trien-11-one
  • 4-Methoxy-15-methyl-17-[4-(propan-2-yl)benzenesulfonyl]-2-oxa-15-azatetracyclo[7.5.3.0^{1,10}.0^{3,8}]heptadeca-3,5,7-trien-16-one
  • 4-Chloro-12-(4-fluorobenzenesulfonyl)-9,10-dimethyl-8-oxa-10-azatricyclo[7.3.1.0^{2,7}]trideca-2,4,6-trien-11-one
  • 2-{[11-(hydroxymethyl)-14-methyl-5-(4-methylphenyl)-2-oxa-4,6,13-triazatricyclo[8.4.0.0^{3,8}]tetradeca-1(10),3(8),4,6,11,13-hexaen-7-yl]sulfanyl}-N-(4-methylphenyl)acetamide
  • 2-{[5-(4-fluorophenyl)-11-(hydroxymethyl)-14-methyl-2-oxa-4,6,13-triazatricyclo[8.4.0.0^{3,8}]tetradeca-1(10),3(8),4,6,11,13-hexaen-7-yl]sulfanyl}-N-methyl-N-phenylacetamide
  • 2-Cyclopentyl-1-[4-(1,2,5-thiadiazol-3-yl)piperazin-1-yl]ethan-1-one
  • (2E)-3-(furan-2-yl)-1-[4-(1,2,5-thiadiazol-3-yl)piperazin-1-yl]prop-2-en-1-one
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