3-(Trifluoromethyl)-s-triazolo[3,4-a]isoquinoline

Modify Date: 2025-08-26 11:50:24

3-(Trifluoromethyl)-s-triazolo[3,4-a]isoquinoline Structure
3-(Trifluoromethyl)-s-triazolo[3,4-a]isoquinoline structure
Common Name 3-(Trifluoromethyl)-s-triazolo[3,4-a]isoquinoline
CAS Number 27022-50-0 Molecular Weight 237.18100
Density 1.49g/cm3 Boiling Point N/A
Molecular Formula C11H6F3N3 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 3-(trifluoromethyl)-[1,2,4]triazolo[3,4-a]isoquinoline
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.49g/cm3
Molecular Formula C11H6F3N3
Molecular Weight 237.18100
Exact Mass 237.05100
PSA 30.19000
LogP 2.90130
Index of Refraction 1.621

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ5479500
CHEMICAL NAME :
s-Triazolo(3,4-a)isoquinoline, 3-(trifluoromethyl)-
CAS REGISTRY NUMBER :
27022-50-0
LAST UPDATED :
199612
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C11-H6-F3-N3
MOLECULAR WEIGHT :
237.20
WISWESSER LINE NOTATION :
T B566 CNN FNJ EXFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
660 mg/kg
TOXIC EFFECTS :
Behavioral - changes in motor activity (specific assay) Behavioral - ataxia Lungs, Thorax, or Respiration - dyspnea
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: 212,205,1974
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
487 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #3873705
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
720 mg/kg
TOXIC EFFECTS :
Behavioral - changes in motor activity (specific assay) Behavioral - ataxia Lungs, Thorax, or Respiration - dyspnea
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: 212,205,1974
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
440 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #3873705

 Safety Information

HS Code 2933990090

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 Synonyms

3-Trifluormethyl-s-triazolo<3,4-a>isochinolin
NC 1140
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