Structure

2-(Trifluoromethyl)benzyl alcohol

CAS
346-06-5
Catalog Number
ACM346065
Category
Aryl
Molecular Weight
176.14
Molecular Formula
C13H11Br

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Specification

Hazard Statements
H314
Symbol
GHS05
What is the molecular formula of 2-(Trifluoromethyl)benzyl alcohol?

The molecular formula is C8H7F3O.

What is the molecular weight of 2-(Trifluoromethyl)benzyl alcohol?

The molecular weight is 176.14 g/mol.

What is the IUPAC name of 2-(Trifluoromethyl)benzyl alcohol?

The IUPAC name is [2-(trifluoromethyl)phenyl]methanol.

What is the InChI of 2-(Trifluoromethyl)benzyl alcohol?

The InChI is InChI=1S/C8H7F3O/c9-8(10,11)7-4-2-1-3-6(7)5-12/h1-4,12H,5H2.

What is the InChIKey of 2-(Trifluoromethyl)benzyl alcohol?

The InChIKey is TWQNSHZTQSLJEE-UHFFFAOYSA-N.

What is the CAS number of 2-(Trifluoromethyl)benzyl alcohol?

The CAS number is 346-06-5.

What is the European Community (EC) Number of 2-(Trifluoromethyl)benzyl alcohol?

The European Community (EC) Number is 206-467-9.

What is the DSSTox Substance ID of 2-(Trifluoromethyl)benzyl alcohol?

The DSSTox Substance ID is DTXSID10188166.

Is 2-(Trifluoromethyl)benzyl alcohol a canonicalized compound?

Yes, it is a canonicalized compound.

Upstream Synthesis Route 1

  • 447-61-0
  • 346-06-5

Reference: [1] Patent: CN106588673, 2017, A, . Location in patent: Paragraph 0047; 0048

Upstream Synthesis Route 2

  • 344-96-7
  • 346-06-5

Reference: [1] Catalysis Science and Technology, 2017, vol. 7, # 6, p. 1297 - 1304
[2] Patent: CN105237342, 2016, A, . Location in patent: Paragraph 0023; 0024; 0040

Upstream Synthesis Route 3

  • 433-97-6
  • 346-06-5

Reference: [1]Journal of Pharmaceutical Sciences,1962,vol. 51,p. 881 - 884

Downstream Synthesis Route 1

  • 346-06-5
  • 21742-00-7

Reference: [1] Patent: CN106588673, 2017, A, . Location in patent: Paragraph 0049; 0056; 0062

Downstream Synthesis Route 2

  • 346-06-5
  • 395-44-8

Reference: [1]Arzneimittel-Forschung/Drug Research,1965,vol. 15,p. 1251 - 1253
[2]Journal of Pharmaceutical Sciences,1962,vol. 51,p. 881 - 884
[3]Journal of Organic Chemistry,1960,vol. 25,p. 733 - 736
[4]Pest Management Science,2000,vol. 56,p. 875 - 881
[5]Patent: US5270313,1993,A

Downstream Synthesis Route 3

  • 346-06-5
  • 21742-00-7

Reference: [1]Patent: CN106588673,2017,A .Location in patent: Paragraph 0049; 0056; 0062

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

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