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Structure

1,1-Carbonyl-di(1,2,4-triazole)

CAS
41864-22-6
Catalog Number
ACM41864226
Category
Other Products
Molecular Weight
164.12
Molecular Formula
C5H4N6O

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Specification

Synonyms
1,1-CARBONYLDI(1,2,4-TRIAZOLE);CDT;CDT ( N,N-Carbonyl-di-(1,2,3-tiazole));1,1-Carbonylbis(1,2,4-triazole);1,1-Carbonyl-di-(1;N,N-Carbonyl-di-(1,2,4-triazole);1,1-Carbonylbis(1,2,4-triazole)
CDT;Carbonyldi(1,2,4-triazole)
Melting Point
145-150°C
Hazard Statements
Xn
Safety Description
22-26-36/37/39-61
Supplemental Hazard Statements
H302-H318-H361
Symbol
GHS05,GHS07,GHS08
What is the molecular formula of 1,1-Carbonyl-di(1,2,4-triazole)?

The molecular formula is C5H4N6O.

What is the molecular weight of 1,1-Carbonyl-di(1,2,4-triazole)?

The molecular weight is 164.13 g/mol.

What is the IUPAC name of 1,1-Carbonyl-di(1,2,4-triazole)?

The IUPAC name is bis(1,2,4-triazol-1-yl)methanone.

What is the structure of 1,1-Carbonyl-di(1,2,4-triazole)?

The structure is C1=NN(C=N1)C(=O)N2C=NC=N2.

What are some synonyms for 1,1-Carbonyl-di(1,2,4-triazole)?

Some synonyms include 41864-22-6, Di(1H-1,2,4-triazol-1-yl)methanone, 1,1'-CARBONYL-DI(1,2,4-TRIAZOLE).

What is the InChIKey for 1,1-Carbonyl-di(1,2,4-triazole)?

The InChIKey is YHNUDLCUIKMNSN-UHFFFAOYSA-N.

How many hydrogen bond acceptors does 1,1-Carbonyl-di(1,2,4-triazole) have?

It has 5 hydrogen bond acceptors.

What is the topological polar surface area of 1,1-Carbonyl-di(1,2,4-triazole)?

The topological polar surface area is 78.5 Å2.

Is 1,1-Carbonyl-di(1,2,4-triazole) a covalently-bonded unit?

Yes, it is a covalently-bonded unit.

When was the 1,1-Carbonyl-di(1,2,4-triazole) last modified?

It was last modified on 2023-12-30.

Upstream Synthesis Route 1

  • 288-88-0
  • 75-44-5
  • 41864-22-6

Reference: [1] Justus Liebigs Annalen der Chemie, 1957, vol. 609, p. 75,82

Downstream Synthesis Route 1

  • 41864-22-6
  • 1552-96-1
  • 150020-94-3

Reference: [1]Journal of the American Chemical Society,1993,vol. 115,p. 7192 - 7198

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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