Structure

2-Pivalamido-5-(trifluoromethyl)nicotinic acid

Catalog Number
ACMA00001029
Category
Amines
Molecular Weight
290.24
Molecular Formula
C12H12N2O4

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Specification

Hazard Statements
H301
RIDADR
UN 3077 9 / PGIII
Symbol
GHS06
What is the molecular formula of 2-Pivalamido-5-(trifluoromethyl)nicotinic acid?

The molecular formula is C12H13F3N2O3.

What is the molecular weight of 2-Pivalamido-5-(trifluoromethyl)nicotinic acid?

The molecular weight is 290.24 g/mol.

When was 2-Pivalamido-5-(trifluoromethyl)nicotinic acid created?

It was created on April 9, 2013.

When was 2-Pivalamido-5-(trifluoromethyl)nicotinic acid last modified?

It was last modified on November 25, 2023.

What is the IUPAC name of 2-Pivalamido-5-(trifluoromethyl)nicotinic acid?

The IUPAC name is 2-(2,2-dimethylpropanoylamino)-5-(trifluoromethyl)pyridine-3-carboxylic acid.

What is the InChI of 2-Pivalamido-5-(trifluoromethyl)nicotinic acid?

The InChI is InChI=1S/C12H13F3N2O3/c1-11(2,3)10(20)17-8-7(9(18)19)4-6(5-16-8)12(13,14)15/h4-5H,1-3H3,(H,18,19)(H,16,17,20).

What is the InChIKey of 2-Pivalamido-5-(trifluoromethyl)nicotinic acid?

The InChIKey is JUHGLODVLUZCDX-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Pivalamido-5-(trifluoromethyl)nicotinic acid?

The canonical SMILES is CC(C)(C)C(=O)NC1=C(C=C(C=N1)C(F)(F)F)C(=O)O.

What is the XLogP3-AA value of 2-Pivalamido-5-(trifluoromethyl)nicotinic acid?

The XLogP3-AA value is 2.7.

What is the hydrogen bond donor count of 2-Pivalamido-5-(trifluoromethyl)nicotinic acid?

The hydrogen bond donor count is 2.

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