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Structure

2-(Trifluoromethyl)benzoic acid

CAS
433-97-6
Catalog Number
ACM433976
Category
Other Products
Molecular Weight
190.12
Molecular Formula
C8H5F3O2

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Specification

Synonyms
ANTIMONY SODIUM FLUORIDE;SODIUM HEXAFLUOROANTIMONATE(V);SODIUM ANTIMONY FLUORIDE;Benzoic acid, 2-(trifluoromethyl)-;2-(Trifluoromethyl)benzoic;à,à,à-trifluoro-o-toluic acid;α,α,α-trifluoro-o-toluic acid;2-(Trifluoromethyl)benzoic acid 98%
Boiling Point
247°C753mm Hg(lit.)
Melting Point
107-110°C(lit.)
Flash Point
247-254°C
Density
3.375g/mL at 25°C(lit.)
Hazard Statements
Xn,N,Xi
Safety Description
61-36-26
Supplemental Hazard Statements
H315-H319-H335
Symbol
GHS07
What is the molecular formula of 2-(Trifluoromethyl)benzoic acid?

The molecular formula of 2-(Trifluoromethyl)benzoic acid is C8H5F3O2.

What is the molecular weight of 2-(Trifluoromethyl)benzoic acid?

The molecular weight of 2-(Trifluoromethyl)benzoic acid is 190.12 g/mol.

What is the IUPAC name of 2-(Trifluoromethyl)benzoic acid?

The IUPAC name of 2-(Trifluoromethyl)benzoic acid is 2-(trifluoromethyl)benzoic acid.

What is the InChI of 2-(Trifluoromethyl)benzoic acid?

The InChI of 2-(Trifluoromethyl)benzoic acid is InChI=1S/C8H5F3O2/c9-8(10,11)6-4-2-1-3-5(6)7(12)13/h1-4H,(H,12,13).

What is the InChIKey of 2-(Trifluoromethyl)benzoic acid?

The InChIKey of 2-(Trifluoromethyl)benzoic acid is FBRJYBGLCHWYOE-UHFFFAOYSA-N.

How many hydrogen bond donor atoms does 2-(Trifluoromethyl)benzoic acid have?

2-(Trifluoromethyl)benzoic acid has 1 hydrogen bond donor atom.

How many hydrogen bond acceptor atoms does 2-(Trifluoromethyl)benzoic acid have?

2-(Trifluoromethyl)benzoic acid has 5 hydrogen bond acceptor atoms.

How many rotatable bonds does 2-(Trifluoromethyl)benzoic acid have?

2-(Trifluoromethyl)benzoic acid has 1 rotatable bond.

What is the topological polar surface area of 2-(Trifluoromethyl)benzoic acid?

The topological polar surface area of 2-(Trifluoromethyl)benzoic acid is 37.3 ?2.

How many defined atom stereocenters does 2-(Trifluoromethyl)benzoic acid have?

2-(Trifluoromethyl)benzoic acid does not have any defined atom stereocenters.

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