Structure

2,6-Dibromo-benzothiazole

CAS
408328-13-2
Catalog Number
ACM408328132
Category
Bromine Series
Molecular Weight
292.98
Molecular Formula
C7H3NBr2S

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Specification

Synonyms
Benzothiazole, 2,6-dibromo-;2,6-Dibromo-benzothiazole
What is the molecular formula of 2,6-Dibromo-benzothiazole?

The molecular formula of 2,6-Dibromo-benzothiazole is C7H3Br2NS.

What is the molecular weight of 2,6-Dibromo-benzothiazole?

The molecular weight of 2,6-Dibromo-benzothiazole is 292.98 g/mol.

What is the IUPAC name of 2,6-Dibromo-benzothiazole?

The IUPAC name of 2,6-Dibromo-benzothiazole is 2,6-dibromo-1,3-benzothiazole.

What is the InChI of 2,6-Dibromo-benzothiazole?

The InChI of 2,6-Dibromo-benzothiazole is InChI=1S/C7H3Br2NS/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H.

What is the InChIKey of 2,6-Dibromo-benzothiazole?

The InChIKey of 2,6-Dibromo-benzothiazole is LQVHXPZEBKDACR-UHFFFAOYSA-N.

What is the canonical SMILES of 2,6-Dibromo-benzothiazole?

The canonical SMILES of 2,6-Dibromo-benzothiazole is C1=CC2=C(C=C1Br)SC(=N2)Br.

What is the CAS number of 2,6-Dibromo-benzothiazole?

The CAS number of 2,6-Dibromo-benzothiazole is 408328-13-2.

What is the DSSTox Substance ID of 2,6-Dibromo-benzothiazole?

The DSSTox Substance ID of 2,6-Dibromo-benzothiazole is DTXSID00646563.

What is the XLogP3 value of 2,6-Dibromo-benzothiazole?

The XLogP3 value of 2,6-Dibromo-benzothiazole is 4.3.

Is 2,6-Dibromo-benzothiazole a canonicalized compound?

Yes, 2,6-Dibromo-benzothiazole is a canonicalized compound according to PubChem.

Downstream Synthesis Route 1

  • 408328-13-2
  • 62266-82-4

Reference: [1] Journal of Organic Chemistry, 1953, vol. 18, p. 1092,1099

Downstream Synthesis Route 2

  • 408328-13-2
  • 62266-82-4

Reference: [1]Journal of Organic Chemistry,1953,vol. 18,p. 1092,1099

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

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