5-Bromo-2-hydroxy-3-iodopyridine

CAT: 0127-OR345330-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR345330-01Size:250 mg

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

381233-75-6

MDL Number

MFCD08688586

Purity

99%

Smiles

Oc1ncc(Br)cc1I

Chemical Information

5-Bromo-3-iodopyridin-2-ol

CAS Number	381233-75-6
PubChem CID	12027787
IUPAC Name	5-bromo-3-iodo-1H-pyridin-2-one
Molecular Formula	C5H3BrINO
Molecular Weight	299.89
XLogP	1.3
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	209

SMILES

C1=C(C(=O)NC=C1Br)I

InChI

InChI=1S/C5H3BrINO/c6-3-1-4(7)5(9)8-2-3/h1-2H,(H,8,9)

InChIKey

WAUPPDAXWKLNNU-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 381233-75-6

CID: 12027787

Formula: C5H3BrINO

MW: 299.89

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	299.89
XLogP3	1.3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	298.84427
Monoisotopic Mass	298.84427
Topological Polar Surface Area	29.1 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	209
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