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2-Hydroxypyridine-N-oxide

CAT: 0862-GK4072-5gSize: 5 gDry Ice: NoHazardous: No
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CAT#:0862-GK4072-5gSize:5 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
13161-30-3
EC Number
236-100-8
MDL Number
MFCD00006195
HS Code
29333999
Purity
98.00%
Molecular Formula
C5H5NO2
Molecular Weight
111.1
Storage Conditions
+20°C
Hazardous Class
Not hazardous

Chemical Information

Hydroxypyridinone

structure in first source

CAS Number13161-30-3
PubChem CID69975
IUPAC Name1-hydroxypyridin-2-one
Molecular FormulaC5H5NO2
Molecular Weight111.10
XLogP-0.7
Topological Polar Surface Area40.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity160
SMILES
C1=CC(=O)N(C=C1)O
InChI
InChI=1S/C5H5NO2/c7-5-3-1-2-4-6(5)8/h1-4,8H
InChIKey
SNUSZUYTMHKCPM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Hydroxypyridinone
CAS: 13161-30-3
CID: 69975
Formula: C5H5NO2
MW: 111.10
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight111.10
XLogP3-0.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass111.032028402
Monoisotopic Mass111.032028402
Topological Polar Surface Area40.5 Ų
Heavy Atom Count8
Formal Charge0
Complexity160
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes