4-Methyloxazole
Properties
- Molecular formula
- C4H5NO
- Molar mass
- 83.09 g/mol
- Exact mass
- 83.0371 Da
- Boiling point
- 88 °C
- logP
- 0.98Crippen estimate
- Polar surface area
- 26.0 Ų
- H-bond donors / acceptors
- 0 / 2
- Rotatable bonds
- 0
Hazards
Danger
- H225 Highly Flammable liquid and vapor66.7% of notifiers
- H315 Causes skin irritation66.7% of notifiers
- H318 Causes serious eye damage33.3% of notifiers
- H319 Causes serious eye irritation66.7% of notifiers
- H335 May cause respiratory irritation66.7% of notifiers
Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501
Identifiers
CAS number
693-93-6SMILES
Cc1cocn1InChIKey
PUMREIFKTMLCAF-UHFFFAOYSA-NInChI
InChI=1S/C4H5NO/c1-4-2-6-3-5-4/h2-3H,1H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- Oxazole, 4-methyl-
Work with 4-Methyloxazole
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
2,5-Dimethylpyrazine123-32-038 % similar
Oxazole-4-carbaldehyde118994-84-637 % similar
1,3-Oxazol-4-ylmethanol155742-48-637 % similar
4-Oxazolecarbonitrile55242-84-737 % similar
4,6-Dimethylpyrimidine1558-17-435 % similar
2,4-Dimethyloxazole7208-05-135 % similar
4-Oxazolecarboxylic acid23012-13-733 % similar
2-Amino-4-methyloxazole35629-70-032 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.