3-Bromo-6-hydroxy-2-methylpyridine

CAT: 0024-sc-231532Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-231532Size:1 g

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CAS Number

54923-31-8

Chemical Information

3-Bromo-6-hydroxy-2-methylpyridine

CAS Number	54923-31-8
PubChem CID	2734417
IUPAC Name	5-bromo-6-methyl-1H-pyridin-2-one
Molecular Formula	C6H6BrNO
Molecular Weight	188.02
XLogP	1
Topological Polar Surface Area	29.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Heavy Atom Count	9
Formal Charge	0
Complexity	205

SMILES

CC1=C(C=CC(=O)N1)Br

InChI

InChI=1S/C6H6BrNO/c1-4-5(7)2-3-6(9)8-4/h2-3H,1H3,(H,8,9)

InChIKey

UJHCRBDEJPQFIA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 54923-31-8

CID: 2734417

Formula: C6H6BrNO

MW: 188.02

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	188.02
XLogP3	1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	186.96328
Monoisotopic Mass	186.96328
Topological Polar Surface Area	29.1 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	205
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-225958	3-Bromo-2-hydroxy-5-methylpyridine
sc-254777	5-Bromo-2-hydroxy-3-methylpyridine
sc-238077	2-Hydroxy-6-methylpyridine
sc-238077A	2-Hydroxy-6-methylpyridine
sc-256091	2-Bromo-6-methylpyridine
sc-259805A	2-Ethyl-3-hydroxy-6-methylpyridine
sc-259805	2-Ethyl-3-hydroxy-6-methylpyridine
sc-226086	3-Hydroxy-2-iodo-6-methylpyridine
sc-259805B	2-Ethyl-3-hydroxy-6-methylpyridine
sc-278518	6-Hydroxy-3-iodo-2-methylpyridine

Catalog	Name
abx183367-01	3-Bromo-6-hydroxy-2-methylpyridine
415771-01	2-Bromo-3-hydroxy-6-methylpyridine
OR345086-01	5-Bromo-6-hydroxy-2-methylpyridine
231735-01	3-Bromo-6-hydroxy-2-methylpyridine 98+% (HPLC)
JDA72513	5-Bromo-2-hydroxy-6-methylpyridine-3-carbonitrile
OR1086042-01	6-Bromo-2-chloro-3-hydroxy-4-methylpyridine
230377-01	2-Hydroxy-3-bromo-6-methylpyridine 98+% (GC)
abx183687-01	5-Bromo-2-hydroxy-3-methylpyridine
OR345364-01	2-Bromo-5-hydroxy-3-methylpyridine
266440-01	3-Bromo-2-hydroxy-5-methylpyridine