4,4-Dimethyloxazolidine
Properties
- Molecular formula
- C5H11NO
- Molar mass
- 101.15 g/mol
- Exact mass
- 101.0841 Da
- Boiling point
- 126–130 °C
- pKa
- 9.35
- Flash point
- 49 °C (closed cup)
- Water solubility
- miscible
- logP
- 0.34Crippen estimate
- Polar surface area
- 21.3 Ų
- H-bond donors / acceptors
- 1 / 2
- Rotatable bonds
- 0
Hazards
Danger
- H226 Flammable liquid and vapor96% of notifiers
- H302+H332 Harmful if swallowed or if inhaled37.3% of notifiers
- H302 Harmful if swallowed97.9% of notifiers
- H312 Harmful in contact with skin17.6% of notifiers
- H315 Causes skin irritation92.2% of notifiers
- H318 Causes serious eye damage97.5% of notifiers
- H332 Harmful if inhaled91.5% of notifiers
Aggregated from 1,462 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, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P354+P338, P317, P321, P330, P332+P317, P362+P364, P370+P378, P403+P235, P501
Identifiers
CAS number
51200-87-4SMILES
CC1(C)COCN1InChIKey
GUQMDNQYMMRJPY-UHFFFAOYSA-NInChI
InChI=1S/C5H11NO/c1-5(2)3-7-4-6-5/h6H,3-4H2,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
14 names · show all
- Oxazolidine, 4,4-dimethyl-
- 4,4-Dimethyl-1,3-oxazolidine
- Oxazolidine A
- Oxadine A
- Zoldine ZA
- Oxaban A
- Nuosept 101
- Nuospet 101
- 4,4-Dimethyl-1-oxa-3-azacyclopentane
- Truptan OX-I
- Nuosept 166
- Mergal 186
- Mergal 192
- 4,4-Dimethyl oxazolidine
Work with 4,4-Dimethyloxazolidine
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
Tanimoto similarity of circular fingerprints over the whole catalogue.