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Methyl pyruvate

CAT: 0286-M27610-01Size: 25 gDry Ice: NoHazardous: Yes
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CAT#:0286-M27610-01Size:25 g
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CAS Number
600-22-6
Synonyms
Methyl 2-oxopropanoate
UN Code
UN3272
Pictogram
02 - Flammable; 07 - Irritant
UDF Signal Word
Warning
MDL Number
MFCD00008754
Hazard Statement
H226 Flammable liquid and vapor; H302 Harmful if swallowed; H312 Harmful in contact with skin; H315 Causes skin irritation; H319 Causes serious eye irritation; H332 Harmful if inhaled; H335 May cause respiratory irritation.
DOT Name
Esters, N.O.S.
DOT Classification
Class 3
Packaging Group
PGIII
Precautions
P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking; P261 Avoid breathing dust/fume/gas/mist/vapors/spray; P280 Wear protective gloves/protective clothing/eye protection/face protection; P301+P312 IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell; P302+P352 IF ON SKIN: wash with plenty of soap and water; P304+P340 IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing; P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P332+P313 IF SKIN irritation occurs: Get medical advice/attention; P403+P235 Store in a well-ventilated place. Keep cool.

Chemical Information

Methyl pyruvate

Methyl pyruvate is a pyruvate ester resultinf grom the formal condensation of the carboxy group of pyruvic acid with the hydroxy group of methanol. It is a methyl ester and a pyruvate ester. It is functionally related to a pyruvic acid.

CAS Number600-22-6
PubChem CID11748
IUPAC Namemethyl 2-oxopropanoate
Molecular FormulaC4H6O3
Molecular Weight102.09
XLogP0
Topological Polar Surface Area43.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count7
Formal Charge0
Complexity95
SMILES
CC(=O)C(=O)OC
InChI
InChI=1S/C4H6O3/c1-3(5)4(6)7-2/h1-2H3
InChIKey
CWKLZLBVOJRSOM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Methyl pyruvate
CAS: 600-22-6
CID: 11748
Formula: C4H6O3
MW: 102.09
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight102.09
XLogP30
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass102.031694049
Monoisotopic Mass102.031694049
Topological Polar Surface Area43.4 Ų
Heavy Atom Count7
Formal Charge0
Complexity95.1
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