| Identification | More | [Name]
Methyl 3-oxovalerate | [CAS]
30414-53-0 | [Synonyms]
3-KETO-N-VALERIC ACID METHYL ESTER
3-KETOVALERIC ACID METHYL ESTER
3-OXOPENTANOIC ACID METHYL ESTER
3-OXOVALERIC ACID METHYL ESTER
METHYL 3-OXOPENTANOATE
METHYL 3-OXOVALERATE
METHYL PROPIONYLACETATE
MOP
PEM
PROPIONYLACETIC ACID METHYL ESTER
3-oxo-methylvalerate
Methy3-oxo-valerate
Methyl 3-oxo-n-valerate
Methyl beta-ketovalerate
methyl3-0xopentanoate
Valeric acid, 3-oxo-, methyl ester
Methylpropionlyacetate
Methyl propionylacetate Methyl 3-oxoval erate
METHYL 3-OXOVALERATE, WACKER QUALITY
Methyl-3-Oxo-Pentanoate99% | [EINECS(EC#)]
250-184-3 | [Molecular Formula]
C6H10O3 | [MDL Number]
MFCD00011705 | [Molecular Weight]
130.14 | [MOL File]
30414-53-0.mol |
| Chemical Properties | Back Directory | [Appearance]
clear colorless to slightly yellow liquid | [Melting point ]
-35 °C | [Boiling point ]
73-74 °C5 mm Hg(lit.) | [density ]
1.037 g/mL at 25 °C(lit.)
| [refractive index ]
n20/D 1.422(lit.)
| [Fp ]
71 °C
| [storage temp. ]
Store below +30°C. | [solubility ]
Chloroform | [form ]
Liquid | [pka]
10.56±0.46(Predicted) | [color ]
Clear colorless to slightly yellow | [Specific Gravity]
1.05 | [Water Solubility ]
SLIGHTLY SOLUBLE | [BRN ]
1753684 | [InChIKey]
XJMIXEAZMCTAGH-UHFFFAOYSA-N | [CAS DataBase Reference]
30414-53-0(CAS DataBase Reference) | [NIST Chemistry Reference]
Pentanoic acid, 3-oxo-, methyl ester(30414-53-0) |
| Safety Data | Back Directory | [Hazard Codes ]
F,Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S24/25:Avoid contact with skin and eyes .
S36:Wear suitable protective clothing .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice . | [WGK Germany ]
3
| [Hazard Note ]
Flammable | [HazardClass ]
IRRITANT | [HS Code ]
29183000 |
| Raw materials And Preparation Products | Back Directory | [Raw materials]
Ammonium hydroxide-->Ammonium chloride-->Methyl acetoacetate-->2-Pentenoic acid, 3-amino-, methyl ester, (2Z)--->Hexanoicacid, 2,4-dioxo-, methyl ester-->Methyl malonyl chloride-->3-OxopentanoicAcid-->5-(1-hydroxypropylidene)-2,2-diMethyl-1,3-dioxane-4,6-dione-->METHYL 2-PENTYNOATE-->ethylmagnesium iodide-->2,2-diMethyl-5-propanoyl-1,3-dioxane-4,6-dione-->Potassium 3-methoxy-3-oxopropanoate-->Methyl cyanoacetate-->2-Butanone | [Preparation Products]
2-(5-METHYL-2-PHENYL-1,3-OXAZOL-4-YL)ACETIC ACID-->4-ETHYL-6-HYDROXY-2-METHYLPYRIMIDINE-->2-(2,5-DIMETHYL-1,3-THIAZOL-4-YL)ACETIC ACID-->METHYL 2-(2,5-DIMETHYL-1,3-THIAZOL-4-YL)ACETATE-->METHYL 4-BROMO-3-OXOPENTANOATE-->2-ETHYL-4-METHYLQUINOLINE-3-CARBOXYLIC ACID-->TAK-441-->methyl 3-oxohept-6-ynoate |
| Hazard Information | Back Directory | [Chemical Properties]
clear colorless to slightly yellow liquid | [Uses]
Methyl 3-oxovalerate is used in the synthesis of anti-Perol stereospecific reductases that can be used in the asymmettric and environmentally friendly reduction of ketones.
| [Uses]
Methyl Propionylacetate is used in the synthesis of anti-Perol stereospecific reductases that can be used in the asymmettric and environmentally friendly reduction of ketones. | [Synthesis Reference(s)]
Journal of the American Chemical Society, 92, p. 6702, 1970 DOI: 10.1021/ja00725a088
The Journal of Organic Chemistry, 43, p. 2087, 1978 DOI: 10.1021/jo00404a066 |
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