chempirical

2-Vinyl-4,4-dimethylazlactone

C7H9NO2CAS 29513-26-6139.15 g/mol

Open in Covalent MOL file
NOO
AlkeneEsterLactone

Properties

Molecular formula
C7H9NO2
Molar mass
139.15 g/mol
Exact mass
139.0633 Da
logP
0.91Crippen estimate
Polar surface area
38.7 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

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
29513-26-6
SMILES
C=CC1=NC(C)(C)C(=O)O1
InChIKey
QKPKBBFSFQAMIY-UHFFFAOYSA-N
InChI
InChI=1S/C7H9NO2/c1-4-5-8-7(2,3)6(9)10-5/h4H,1H2,2-3H3

Weigh it out

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

Names and synonyms

15 names · show all
  • 5(4H)-Oxazolone, 2-ethenyl-4,4-dimethyl-
  • 2-Oxazolin-5-one, 4,4-dimethyl-2-vinyl-
  • 2-Ethenyl-4,4-dimethyl-5(4H)-oxazolone
  • 2-Vinyl-4,4-dimethyl-5-oxazolone
  • 2-Ethenyl-4,4-dimethyl-1,3-oxazolin-5-one
  • 4,4-Dimethyl-2-vinyl-2-oxazolin-5-one
  • 2-Vinyl-4,4-dimethyl-2-oxazolin-5-one
  • 4,4-Dimethyl-2-vinyl-5(4H)-oxazolone
  • 4,4-Dimethyl-2-vinylazlactone
  • Vinyldimethylazlactone
  • 4,4-Dimethyl-2-vinyl-1,3-oxazolin-5-one
  • 4,4-Dimethyl-2-vinyl-1,3-oxazol-5(4H)-one
  • VAL
  • 4,4-Dimethyl-2-vinyl-4H-oxazol-5-one
  • 2-Ethenyl-4,4-dimethyl-1,3-oxazol-5-one

Work with 2-Vinyl-4,4-dimethylazlactone

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,1'-Dimethyl 2,2'-(1,2-diazenediyl)bis(2-methylpropanoate)2589-57-335 % similar tert-Butyl acrylate1663-39-434 % similar Vinyl pivalate3377-92-234 % similar Pivalic anhydride1538-75-632 % similar Acrylic anhydride2051-76-532 % similar Neopentyl glycol diacrylate2223-82-732 % similar tert-Butylacrylamide107-58-431 % similar 1-Methylcyclopentyl prop-2-enoate178889-49-130 % similar

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

Same formula

2-Methoxy-3-pyridinemethanol112197-16-7 2,6-Pyridinedimethanol1195-59-1 4-Pyridinemethanol,2-methoxy-(9ci)123148-66-3 (5-Methoxypyridin-2-yl)methanol127978-70-5 Ethyl 1-cyanocyclopropanecarboxylate1558-81-2 5-Amino-2-methoxyphenol1687-53-2 Ammonium benzoate1863-63-4 (1R,5S)-6,6-Dimethyl-3-azabicyclo[3.1.0]hexane-2,4-dione194421-56-2

Elsewhere

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