Pyruvaldehyde-13C3 (2% aqueous solution)

CAT: 0572-TRC-P998872-2.5MGSize: 2.5 mgDry Ice: NoHazardous: Yes

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CAT#:0572-TRC-P998872-2.5MGSize:2.5 mg

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CAS Number

1353867-77-2

Synonyms

Methylglyoxal-13C3

Hazard Statement

Combustible liquid; UN number: UN3265; Packing Group: I

Smiles

[13CH3][13C]([13CH]=O)=O

Molecular Formula

13C3H4O2

Molecular Weight

75.04

Shipping Conditions

Room Temperature

Storage Conditions

+4°C

Chemical Information

Acetylformaldehyde-13C3

CAS Number	1353867-77-2
PubChem CID	71309869
IUPAC Name	2-oxo(1,2,3-13C3)propanal
Molecular Formula	C3H4O2
Molecular Weight	75.041
XLogP	-0.4
Topological Polar Surface Area	34.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	5
Formal Charge	0
Complexity	55

SMILES

[13CH3][13C](=O)[13CH]=O

InChI

InChI=1S/C3H4O2/c1-3(5)2-4/h2H,1H3/i1+1,2+1,3+1

InChIKey

AIJULSRZWUXGPQ-VMIGTVKRSA-N

Chemical Structure

2D Structure

CAS: 1353867-77-2

CID: 71309869

Formula: C3H4O2

MW: 75.041

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	75.041
XLogP3	-0.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	75.031193872
Monoisotopic Mass	75.031193872
Topological Polar Surface Area	34.1 Å²
Heavy Atom Count	5
Formal Charge	0
Complexity	55.9
Isotope Atom Count	3
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

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TRC-G598203-2.5MG	D-Glyceraldehyde-1,2,3-13C3 (Aqueous Solution)
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TRC-G598221-25MG	DL-Glyceraldehyde-1,2,3-13C3 (~ 0.1M Aqueous Solution) (>85%)
TRC-P689408-2.5G	Polymaleic Acid (Aqueous Solution)
TRC-P689408-1G	Polymaleic Acid (Aqueous Solution)

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Pyruvaldehyde-13C3 (2% aqueous solution)

Chemical Information

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