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Structure

5-Bromo-2-carboxy-3-methylpyridine

CAS
886365-43-1
Catalog Number
ACM886365431
Category
Other Products
Molecular Weight
216.0339
Molecular Formula
C7H6BrNO2

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Specification

Synonyms
5-BROMO-2-CARBOXY-3-METHYLPYRIDINE;5-BROMO-3-METHYL-PYRIDINE-2-CARBOXYLIC ACID;5-broMo-3-Methylpicolinic acid;5-Bromo-3-methylpicolinic acid, 5-Bromo-2-carboxy-3-methylpyridine;2-Pyridinecarboxylicacid, 5-broMo-3-Methyl-
MDL Number
MFCD07375125
Size
1g,5g
Supplemental Hazard Statements
H315-H319-H335
Symbol
GHS07
What is the molecular formula of the compound?

The molecular formula is C7H6BrNO2.

What is the molecular weight of the compound?

The molecular weight is 216.03 g/mol.

What is the IUPAC name of the compound?

The IUPAC name is 5-bromo-3-methylpyridine-2-carboxylic acid.

What is the InChI of the compound?

The InChI is InChI=1S/C7H6BrNO2/c1-4-2-5(8)3-9-6(4)7(10)11/h2-3H,1H3,(H,10,11).

What is the InChIKey of the compound?

The InChIKey is GSOCTKHBFREQCV-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES is CC1=CC(=CN=C1C(=O)O)Br.

What is the CAS number of the compound?

The CAS number is 886365-43-1.

What is the European Community (EC) number of the compound?

The EC number is 689-115-0.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 1.8.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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