8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine | CAS No. 29975-16-4

8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

Basic Information

CAS Number

29975-16-4

Molecular Formula

C16H11ClN4

Molecular Weight

294.75 g/mol

AD

Basic Physical Properties

Melting Point

228-229°

Boiling Point

448.04°C (rough estimate)

Refractive Index

1.6110 (estimate)

c1ccc(cc1)C2=NCc3nncn3-c4c2cc(cc4)Cl

InChI

InChI=1S/C16H11ClN4/c17-12-6-7-14-13(8-12)16(11-4-2-1-3-5-11)18-9-15-20-19-10-21(14)15/h1-8,10H,9H2

InChIKey

CDCHDCWJMGXXRH-UHFFFAOYSA-N

LogP

3.271700000000002

Topological Polar Surface Area

43.07 Ų

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

407

Safety Information

View Safety Information

Hazard Statement

H225 Highly Flammable liquid and vapor
Flammable liquids
H370 Causes damage to organs
Specific target organ toxicity, single exposure

Hazard Class

Class 6.1(b) Class 6.1(b)

Toxicity

LD50 orally in male mice, rats and rabbits: 740, 3200, 300 mg/kg (Yokotani)

Synonyms & References

English

  • estazolam 100 ug per ml in methanol
  • 2,4)triazolo(4,3-a)(1,4)-benzodiazepine,8-chloro-6-phenyl-4h-(
  • 3-a)(1,4)benzodiazepine,8-chloro-6-phenyl-4h-s-triazolo(
  • 4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine, 8-chloro-6-phenyl-
  • 4H-s-Triazolo(4,3-a)(1,4)benzodiazepine, 8-chloro-6-phenyl-
  • 8-Chloro-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine
  • abbott47631
  • Abbott-47631
  • Alprazolam M (hydroxy-)-CH2O
  • ESTAZOLAM
  • Estazolam solution
  • 8-chloro-6-phenyl-9H-s-triazolo<4,3-a><1,4>-benzodiazepine
  • Cannoc
  • d-40ta
  • Esilgan
  • Eurodin
  • Eurodine
  • Julodin
  • Nemurel
  • ProSom
  • 8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

FAQ

What is 8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine (CAS: 29975-16-4)?

8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine (CAS: 29975-16-4) is a synthetic compound that serves as an intermediate in the pharmaceutical industry. This molecule is characterized by its unique chemical structure, including a benzodiazepine ring fused with a triazole ring, and a chlorine substituent. It is not directly used in human or veterinary drugs but plays a role in the synthesis of other pharmaceuticals.

What are the main uses of 8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine (CAS: 29975-16-4)?

The primary use of 8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine (CAS: 29975-16-4) is as an intermediate in the pharmaceutical industry. This compound is involved in the synthesis of other complex molecules and drugs, particularly those targeting nervous system disorders.

Is 8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine (CAS: 29975-16-4) safe?

8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine (CAS: 29975-16-4) is generally safe for use as an intermediate in the pharmaceutical industry when handled with proper precautions. Users should follow safety guidelines, including the use of personal protective equipment (PPE) and appropriate storage practices to prevent accidental exposure.

How should 8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine (CAS: 29975-16-4) be stored?

8-Chloro-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine (CAS: 29975-16-4) should be stored in a tightly closed container in a cool, dry place, away from direct sunlight and heat sources. Maintain a temperature range between 15°C and 30°C and ensure the storage area has a relative humidity below 75%. Avoid contact with incompatible materials such as acids and oxidizers.

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