2,4-Oxazolidinedione
Completing data — refresh the page later to see the latest
Basic information
- CAS
12770-97-7- Standard SMILES
O=C1COC(=O)N1- InChIKey
COWNFYYYZFRNOY-UHFFFAOYSA-N- Molecular formula
- C3H3NO3
- Average molar mass
- 101.06 g/mol
- Monoisotopic mass
- 101.01129296
Overview
structure given in first source
Names & identifiers
- Preferred name
- 2,4-Oxazolidinedione
- IUPAC
- 1,3-oxazolidine-2,4-dione
- English name
- 2,4-OXAZOLIDINEDIONE
- Molecular formula
- C3H3NO3
- Molecular weight
- 101.06
Names & synonyms
2,4-Oxazolidinedione2346-26-12,4-OxazolidenedioneNSC-120350R22D15229RDTXSID60894083RefChem:443942DTXCID401324124OXAZOLIDINE-2,4-DIONE1,3-oxazolidine-2,4-dioneOxazolidinedioneMFCD02691902
Show more names
Oxazolidin-2,4-dione2-2,4-OXAZOLIDINEDIONE9-chloronicotinaldehyde2,4-Oxazolidinedione (7CI, 8CI, 9CI, ACI)
NSC 12035012770-97-7hydroxyoxazolinone1,3-oxazolidin-2,4-dioneUNII-R22D15229RCMLDBU000035112,4oxazolidinedione2,4oxa
Database identifiers
- CAS
12770-97-7、2346-26-1- PubChem CID
- 97389
- DTXSID
DTXSID60894083- UNII
- R22D15229R
- EC Number
- 874-748-9
- Nikkaji
- J1.024.458G
Properties
Computed structural propertiesFilling in
- XLogP
- -0.5
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 119
Physicochemical properties
- Melting point
- 89 · 89-90 °C
- Boiling point
- 173 °C · 173 °C(Press: 11 Torr)
- Density
- 1.469 · 1.469±0.06 g/cm3(Predicted)
- storage temp.
- 2 · under inert gas (nitrogen or Argon) at 2-8°C
- pka
- 6 · 6.00±0.50(Predicted)
- Appearance
- White to light yellow Solid
- FDA UNII
- 22 D15229R · R22D15229R
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
92 records
Compound notes
Loading…