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Pyruvaldehyde (35% w/w aqueous)

CAT: 0572-TRC-P998870-10GSize: 10 gDry Ice: NoHazardous: Yes
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CAT#:0572-TRC-P998870-10GSize:10 g
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CAS Number
78-98-8
Hazard Statement
Combustible liquid and vapour; UN number: UN3265; Packing Group: III
Smiles
CC(=O)C=O
Molecular Formula
C3 H4 O2
Molecular Weight
72.06
InChI
InChI=1S/C3H4O2/c1-3(5)2-4/h2H,1H3
Additionnal Information
IUPAC name: 2-oxopropanal
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Methylglyoxal

Methylglyoxal is a 2-oxo aldehyde derived from propanal. It has a role as a mouse metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite and a human metabolite. It is a member of propanals and a 2-oxo aldehyde.

CAS Number78-98-8
PubChem CID880
IUPAC Name2-oxopropanal
Molecular FormulaC3H4O2
Molecular Weight72.06
XLogP-0.4
Topological Polar Surface Area34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count5
Formal Charge0
Complexity55
SMILES
CC(=O)C=O
InChI
InChI=1S/C3H4O2/c1-3(5)2-4/h2H,1H3
InChIKey
AIJULSRZWUXGPQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methylglyoxal
CAS: 78-98-8
CID: 880
Formula: C3H4O2
MW: 72.06
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight72.06
XLogP3-0.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass72.021129366
Monoisotopic Mass72.021129366
Topological Polar Surface Area34.1 Ų
Heavy Atom Count5
Formal Charge0
Complexity55.9
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