chempirical

2-Methylprop-1-en-1-one

C4H6OCAS 598-26-570.09 g/mol

Open in Covalent MOL file
O

Properties

Molecular formula
C4H6O
Molar mass
70.09 g/mol
Exact mass
70.0419 Da
Melting point
−97.5 °C
Boiling point
34 °C
logP
0.78Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
598-26-5
SMILES
CC(=C=O)C
InChIKey
VDOKWPVSGXHSNP-UHFFFAOYSA-N
InChI
InChI=1S/C4H6O/c1-4(2)3-5/h1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 1-Propen-1-one, 2-methyl-
  • Dimethylketene
  • 2-Methyl-1-propen-1-one
  • Ketene, dimethyl-
  • 1,1-Dimethylketene
  • 2-Methyl-prop-1-en-1-one

Reactions

Work with 2-Methylprop-1-en-1-one

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

3-Methyl-1,2-butadiene598-25-433 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Divinyl ether109-93-3 Cyclobutanone1191-95-3 2,3-Dihydrofuran1191-99-7 trans-Crotonaldehyde123-73-9 Cyclopropanecarboxaldehyde1489-69-6 2,5-Dihydrofuran1708-29-8 3-Butyn-2-ol2028-63-9 (S)-(-)-1-Butyn-3-ol2914-69-4

Elsewhere

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