ChemicalBook--->CAS DataBase List--->31915-82-9

31915-82-9

31915-82-9 Structure

31915-82-9 Structure
IdentificationMore
[Name]

2-Oxopropanal oxime
[CAS]

31915-82-9
[Synonyms]

ANTI-PYRUVIC ALDEHYDE 1-OXIME 98
Pyruvaldoxim
2-OXOPROPANAL OXIME
Pyruvic aldehyde-1-oxime
[Molecular Formula]

C3H5NO2
[MDL Number]

MFCD00002123
[Molecular Weight]

87.0773
[MOL File]

31915-82-9.mol
Chemical PropertiesBack Directory
[Melting point ]

65-67 °C (lit.)
[Boiling point ]

193.0±23.0 °C(Predicted)
[density ]

1.10±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

solid
[pka]

8.70±0.40(Predicted)
[InChI]

1S/C3H5NO2/c1-3(5)2-4-6/h2,6H,1H3/b4-2+
[InChIKey]

OVGLVOLWBBGQHS-DUXPYHPUSA-N
[SMILES]

CC(=O)\C=N\O
[CAS DataBase Reference]

31915-82-9(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

anti-Pyruvic aldehyde 1-oxime may be used in chemical synthesis.
[Purification Methods]

Crystallise isonitrosoacetone from *C6H6, ether/pet ether or CCl4. It sublimes at 90-100o (water bath temperature)/0.05mm [Kahovec & Kohlrausch Chem Ber 75 1547 1942]. It forms an iron and a Cu2+ salt (m 170o dec). [Beilstein 1 H 763, 1 I 396, 1 II 822, 1 III 3092, 1 IV 3632.]
Spectrum DetailBack Directory
[Spectrum Detail]

2-Oxopropanal oxime(31915-82-9)1HNMR
2-Oxopropanal oxime(31915-82-9)Raman
2-Oxopropanal oxime(31915-82-9)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

31915-82-9(sigmaaldrich)
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