chempirical

2-Ethyl-2-oxazoline

C5H9NOCAS 10431-98-899.13 g/mol

Open in Covalent MOL file
NO

Properties

Molecular formula
C5H9NO
Molar mass
99.13 g/mol
Exact mass
99.0684 Da
Boiling point
56–58 °C (at 100 Torr)
logP
0.83Crippen estimate
Polar surface area
21.6 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
10431-98-8
SMILES
CCC1=NCCO1
InChIKey
NYEZZYQZRQDLEH-UHFFFAOYSA-N
InChI
InChI=1S/C5H9NO/c1-2-5-6-3-4-7-5/h2-4H2,1H3

Weigh it out

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

Names and synonyms

5 names
  • Oxazole, 2-ethyl-4,5-dihydro-
  • 2-Oxazoline, 2-ethyl-
  • 2-Ethyl-4,5-dihydrooxazole
  • 2-Ethyloxazoline
  • NSC 136557

Work with 2-Ethyl-2-oxazoline

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

2-Methyl-2-oxazoline1120-64-544 % similar 2-Oxazolidone497-25-638 % similar 2,2′-(1,3-Phenylene)bis(2-oxazoline)34052-90-930 % similar Rilmenidine54187-04-130 % similar Propyl propanoate106-36-530 % similar

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

Same formula

Butyl isocyanate111-36-4 4-Amino-3-penten-2-one1118-66-7 Cyclopentanone oxime1192-28-5 tert-Butyl isocyanate1609-86-5 3-Ethoxypropanenitrile2141-62-0 N,N-Dimethylacrylamide2680-03-7 N-Methyl-N-vinylacetamide3195-78-6 1-Pyrrolidinecarboxaldehyde3760-54-1

Elsewhere

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