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Structure

2-Bromo-5-fluoro-4-methyl-3-nitropyridine

CAS
917918-84-4
Catalog Number
ACM917918844
Category
Bromine Series
Molecular Weight
235.010563 [g/mol]
Molecular Formula
C6H4N2O2BrF

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Specification

Synonyms
2-Bromo-5-fluoro-4-methyl-3-nitropyridine;2-Bromo-5-fluoro-3-nitro-4-picoline;2-Bromo-3-nitro-4-methyl-5-fluoropyridine
IUPAC Name
2-bromo-5-fluoro-4-methyl-3-nitropyridine
InChI Key
GETCZNOCLJMNEA-UHFFFAOYSA-N
Boiling Point
247.3ºC at 760 mmHg
Flash Point
103.4ºC
Density
1.791g/cm³
Exact Mass
233.94400
H-Bond Acceptor
4
H-Bond Donor
0
What is the molecular formula of the compound?

The molecular formula of the compound is C6H4BrFN2O2.

What is the synonym for the compound?

The synonym for the compound is 2-bromo-5-fluoro-4-methyl-3-nitropyridine.

What is the molecular weight of the compound?

The molecular weight of the compound is 235.01 g/mol.

When was the compound created?

The compound was created on May 28, 2009.

When was the compound last modified?

The compound was last modified on December 2, 2023.

What is the IUPAC name of the compound?

The IUPAC name of the compound is 2-bromo-5-fluoro-4-methyl-3-nitropyridine.

What is the InChI of the compound?

The InChI of the compound is InChI=1S/C6H4BrFN2O2/c1-3-4(8)2-9-6(7)5(3)10(11)12/h2H,1H3.

What is the InChIKey of the compound?

The InChIKey of the compound is GETCZNOCLJMNEA-UHFFFAOYSA-N.

What is the canonical SMILES of the compound?

The canonical SMILES of the compound is CC1=C(C(=NC=C1F)Br)[N+](=O)[O-].

What is the XLogP3-AA value of the compound?

The XLogP3-AA value of the compound is 2.2.

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