Pyridine Impurity 7

CAT: 1596-AR-P33362-06Size: 250 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-P33362-06Size:250 Units

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CAS Number

874493-49-9

Molecular Formula

C5H4BrNO2

Molecular Weight

190.00

API Name

Pyridine

Chemical Information

5-Bromo-1-hydroxypyridin-2(1H)-one

CAS Number	874493-49-9
PubChem CID	67281172
IUPAC Name	5-bromo-1-hydroxypyridin-2-one
Molecular Formula	C5H4BrNO2
Molecular Weight	189.99
XLogP	0.3
Topological Polar Surface Area	40.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	9
Formal Charge	0
Complexity	197

SMILES

C1=CC(=O)N(C=C1Br)O

InChI

InChI=1S/C5H4BrNO2/c6-4-1-2-5(8)7(9)3-4/h1-3,9H

InChIKey

TYSIOVAYSVFULC-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 874493-49-9

CID: 67281172

Formula: C5H4BrNO2

MW: 189.99

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	189.99
XLogP3	0.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	188.94254
Monoisotopic Mass	188.94254
Topological Polar Surface Area	40.5 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	197
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
RM-D141609-01	Donepezil Pyridine Dihydro Impurity
RM-I120102-01	Ilaprazole Impurity 2 (Ilaprazole Pyridine N-Oxide)
OR1037374-01	N- (Butylcarbamoyl) -4- (m-tolylamino) pyridine-3-sulfonamide (Torasemide Impurity)
RM-I120130-01	Ilaprazole Impurity 30 (Ilaprazole Pyridine N-Oxide Sodium Salt) discontinued see RM-I120102
OR1075872-01	3-Isopropyl 5- (2-methoxyethyl) 2,6-dimethyl-4- (3-nitrophenyl) pyridine-3,5-dicarboxylate (Nimodipine Impurity)
HY-Z7654R	3-Isopropyl 5- (2-methoxyethyl) 2,6-dimethyl-4- (3-nitrophenyl) pyridine-3,5-dicarboxylate (Nimodipine Impurity) (Standard)
TRC-B426450-25MG	2,3-Bis(1,5-dihydro-5-methyl-5-(1-methylethyl-4H-Imadazol-4-one)-5-methoxymethyl Pyridine (Imazamox Impurity)
159838	2,3-Bis (1,5-dihydro-5-methyl-5- (1-methylethyl-4H-Imadazol-4-one) -5-methoxymethyl Pyridine (Imazamox Impurity)
HY-Z2623R	Ethyl 6- (4- (5-chloropentanamido) phenyl) -1- (4-methoxyphenyl) -7-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-c]pyridine-3-carboxylate (Apixaban Impurity) (Standard)
OR1007707-01	Ethyl 2- (((1S,2R,4S) -4- (dimethylcarbamoyl) -2- (5-methyl-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine-2-carboxamido) cyclohexyl) amino) -2-oxoacetate (Edoxaban Impurity)