5-Bromo-2-ethylpyridine - CAS 38749-90-5

Catalog:	BB023748
Product Name:	5-Bromo-2-ethylpyridine
CAS:	38749-90-5
Synonyms:	5-bromo-2-ethylpyridine; 5-bromo-2-ethylpyridine

Technical Data

Patents

Computed Properties

IUPAC Name:	5-bromo-2-ethylpyridine
Description:	5-Bromo-2-ethylpyridine (CAS# 38749-90-5) is a useful research chemical.
Molecular Weight:	186.05
Molecular Formula:	C7H8BrN
Canonical SMILES:	CCC1=NC=C(C=C1)Br
InChI:	InChI=1S/C7H8BrN/c1-2-7-4-3-6(8)5-9-7/h3-5H,2H2,1H3
InChI Key:	JFTFIPSATYUJLB-UHFFFAOYSA-N
Boiling Point:	201.1 °C at 760 mmHg
Density:	1.413 g/cm³
Appearance:	Liquid
MDL:	MFCD11226235
LogP:	2.40650

Publication Number	Title	Priority Date
WO-2021032992-A1	Pharmaceutical compounds	20190820
WO-2021011713-A1	Imidazopyrimidines as eed inhibitors and the use thereof	20190716
US-10689357-B2	N-acylethanolamine hydrolyzing acid amidase (NAAA) inhibitors and use thereof	20180508
US-2019345132-A1	N-Acylethanolamine Hydrolyzing Acid Amidase (NAAA) Inhibitors And Use Thereof	20180508
WO-2019217977-A1	N-acylethanolamine hydrolyzing acid amidase (naaa) inhibitors and use thereof	20180508

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Complexity:	85
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	184.98401
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	184.98401
Rotatable Bond Count:	1
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4