Methylethyl ketone oxime
Properties
- Molecular formula
- C4H9NO
- Molar mass
- 87.12 g/mol
- Exact mass
- 87.0684 Da
- Density
- 0.9232 g/mL (at 80 °C)
- Melting point
- −29.5 °C
- Boiling point
- 152.5 °C
- pKa
- 12.45 (25 °C)
- Flash point
- 58.9 °C
- Water solubility
- 100 g/L (25 °C)
- logP
- 1.25Crippen estimate
- Polar surface area
- 32.6 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 1
Hazards
Danger
- H301 Toxic if swallowedAcute toxicity, oral
- H312 Harmful in contact with skinAcute toxicity, dermal
- H315 Causes skin irritationSkin corrosion/irritation
- H317 May cause an allergic skin reactionSensitization, Skin
- H318 Causes serious eye damageSerious eye damage/eye irritation
- H336 May cause drowsiness or dizzinessSpecific target organ toxicity, single exposure; Narcotic effects
- H350 May cause cancerCarcinogenicity
- H370 Causes damage to organsSpecific target organ toxicity, single exposure
- H373 May causes damage to organs through prolonged or repeated exposureSpecific target organ toxicity, repeated exposure
Harmonised EU classification (CLP Annex VI, index 616-014-00-0), via PubChem.
Precautionary statements
P203, P260, P261, P264, P264+P265, P270, P271, P272, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P308+P316, P317, P318, P319, P321, P330, P332+P317, P333+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
96-29-7SMILES
CCC(C)=NOInChIKey
WHIVNJATOVLWBW-UHFFFAOYSA-NInChI
InChI=1S/C4H9NO/c1-3-4(2)5-6/h6H,3H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass and density.
Names and synonyms
21 names · show all
- 2-Butanone, oxime
- Methyl ethyl ketoxime
- MEK-oxime
- Ethyl methyl ketoxime
- Methyl ethyl ketone oxime
- Ethyl methyl ketone oxime
- 2-Butoxime
- Aron M 1
- Exkin II
- Exkin 2
- Mekor 70
- NSC 442
- NSC 65465
- Troykyd AntiSkin B
- Hiaron M 1
- Borchinox M 2
- KL 841
- Butoxime
- MSDS
- Skino 2
- 2-Butanone oxime
Work with Methylethyl ketone oxime
Predict the NMR spectrum1H and 13C shifts with multiplicities
Make a solutionWhat to weigh for any molarity and volume
Check drug-likenessLipinski, Veber and lead-likeness
Boiling point under vacuumAt any pressure, from its normal boiling point
Isotope patternExact mass and the mass spectrum pattern
Similar compounds
2,4-Pentanedione oxime2157-56-460 % similar
2-Butanone 2,2′,2′′,2′′′-(O,O′,O′′,O′′′-silanetetrayltetraoxime)34206-40-142 % similar
Methyltris(methyl ethyl ketoxime)silane22984-54-939 % similar
Benzoquinone dioxime105-11-338 % similar
Acetone oxime127-06-038 % similar
Dimethylglyoxime95-45-438 % similar
Ethyl N-hydroxyethanimidate10576-12-237 % similar
Acetohydroxamic acid546-88-335 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.