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Structure

(6-Trifluoromethyl-pyridin-3-yl)-acetic acid

CAS
913839-73-3
Catalog Number
ACM913839733
Category
Other Products
Molecular Weight
205.133950 [g/mol]
Molecular Formula
C8H6F3NO2

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Specification

Synonyms
913839-73-3, 2-(6-(Trifluoromethyl)pyridin-3-yl)acetic acid, (6-TRIFLUOROMETHYL-PYRIDIN-3-YL)-ACETIC ACID, 1000568-14-8, PubChem23900, SureCN263863, CTK3J8463, MolPort-020-007-537, ANW-53180, AKOS015966393, AB55209, AG-D-04106, AK-95485, KB-209062, (2-Trifluoromethyl-pyridin-3-yl)-acetic acid, (6-trifluoromethyl-(pyridin-3-yl))-acetic acid, 2-(TRIFLUOROMETHYL)PYRIDINE-5-ACETIC ACID, 6-(TRIFLUOROMETHYL)-3-PYRIDINEACETIC ACID, 3-PYRIDINEACETIC ACID, 6-(TRIFLUOROMETHYL), 2-(6-(TRIFLUOROMETHYL)(PYRIDIN-3-YL))ACETIC ACID
IUPAC Name
2-[6-(trifluoromethyl)pyridin-3-yl]acetic acid
Canonical SMILES
C1=CC(=NC=C1CC(=O)O)C(F)(F)F
InChI Key
GONSDVSNRVDRPU-UHFFFAOYSA-N
Exact Mass
205.03500
H-Bond Acceptor
6
H-Bond Donor
1
What is the molecular formula of (6-Trifluoromethyl-pyridin-3-yl)-acetic acid?

The molecular formula is C8H6F3NO2.

What is the molecular weight of (6-Trifluoromethyl-pyridin-3-yl)-acetic acid?

The molecular weight is 205.13 g/mol.

What is the IUPAC name of (6-Trifluoromethyl-pyridin-3-yl)-acetic acid?

The IUPAC name is 2-[6-(trifluoromethyl)pyridin-3-yl]acetic acid.

What is the InChI of (6-Trifluoromethyl-pyridin-3-yl)-acetic acid?

The InChI is InChI=1S/C8H6F3NO2/c9-8(10,11)6-2-1-5(4-12-6)3-7(13)14/h1-2,4H,3H2,(H,13,14).

What is the InChIKey of (6-Trifluoromethyl-pyridin-3-yl)-acetic acid?

The InChIKey is GONSDVSNRVDRPU-UHFFFAOYSA-N.

What is the canonical SMILES of (6-Trifluoromethyl-pyridin-3-yl)-acetic acid?

The canonical SMILES is C1=CC(=NC=C1CC(=O)O)C(F)(F)F.

What is the CAS number of (6-Trifluoromethyl-pyridin-3-yl)-acetic acid?

The CAS number is 913839-73-3.

What is the XLogP3-AA value of (6-Trifluoromethyl-pyridin-3-yl)-acetic acid?

The XLogP3-AA value is 1.2.

Is (6-Trifluoromethyl-pyridin-3-yl)-acetic acid a canonicalized compound?

Yes, it is a canonicalized compound.

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