Structure

5-Bromo-2-phenoxypyridine

CAS
59717-96-3
Catalog Number
ACM59717963
Category
Bromine Series
Molecular Weight
250.091320 [g/mol]
Molecular Formula
C11H8BrNO

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Specification

Synonyms
5-Bromo-2-phenoxypyridine, 59717-96-3, PubChem22136, ACMC-209mf6, SureCN510254, MolPort-013-673-390, ANW-33328, AKOS010631458, QC-3579, RL04254, AK-90898, KB-42182
IUPAC Name
5-bromo-2-phenoxypyridine
Canonical SMILES
C1=CC=C(C=C1)OC2=NC=C(C=C2)Br
InChI Key
ZHIHQFMWBOTCQR-UHFFFAOYSA-N
Exact Mass
248.97900
H-Bond Acceptor
2
H-Bond Donor
0
What is the molecular formula of 5-Bromo-2-phenoxypyridine?

The molecular formula of 5-Bromo-2-phenoxypyridine is C11H8BrNO.

What are the synonyms of 5-Bromo-2-phenoxypyridine?

The synonyms of 5-Bromo-2-phenoxypyridine are 59717-96-3, Pyridine 5-bromo-2-phenoxy-, 2-phenoxy-5-bromopyridine, and 5-Bromo-2-phenoxy-pyridine.

What is the molecular weight of 5-Bromo-2-phenoxypyridine?

The molecular weight of 5-Bromo-2-phenoxypyridine is 250.09 g/mol.

When was 5-Bromo-2-phenoxypyridine created and last modified?

5-Bromo-2-phenoxypyridine was created on December 5, 2007, and last modified on December 2, 2023.

What is the IUPAC name of 5-Bromo-2-phenoxypyridine?

The IUPAC name of 5-Bromo-2-phenoxypyridine is 5-bromo-2-phenoxypyridine.

What is the InChI of 5-Bromo-2-phenoxypyridine?

The InChI of 5-Bromo-2-phenoxypyridine is InChI=1S/C11H8BrNO/c12-9-6-7-11(13-8-9)14-10-4-2-1-3-5-10/h1-8H.

What is the InChIKey of 5-Bromo-2-phenoxypyridine?

The InChIKey of 5-Bromo-2-phenoxypyridine is ZHIHQFMWBOTCQR-UHFFFAOYSA-N.

What is the canonical SMILES of 5-Bromo-2-phenoxypyridine?

The canonical SMILES of 5-Bromo-2-phenoxypyridine is C1=CC=C(C=C1)OC2=NC=C(C=C2)Br.

What is the CAS number of 5-Bromo-2-phenoxypyridine?

The CAS number of 5-Bromo-2-phenoxypyridine is 59717-96-3.

What is the molecular weight, XLogP3, hydrogen bond donor count, hydrogen bond acceptor count, rotatable bond count, exact mass, monoisotopic mass, topological polar surface area, heavy atom count, formal charge, complexity, isotope atom count, defined atom stereocenter count, undefined atom stereocenter count, defined bond stereocenter count, undefined bond stereocenter count, covalently-bonded unit count, and if the compound is canonicalized?

The molecular weight is 250.09 g/mol.
The XLogP3 is 3.1.
The hydrogen bond donor count is 0.
The hydrogen bond acceptor count is 2.
The rotatable bond count is 2.
The exact mass is 248.97893 g/mol.
The monoisotopic mass is 248.97893 g/mol.
The topological polar surface area is 22.1Ų.
The heavy atom count is 14.
The formal charge is 0.
The complexity is 171.
The isotope atom count is 0.
The defined atom stereocenter count is 0.
The undefined atom stereocenter count is 0.
The defined bond stereocenter count is 0.
The undefined bond stereocenter count is 0.
The covalently-bonded unit count is 1.
The compound is canonicalized.

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