Basic information
- CAS
58607-24-2- Standard SMILES
CC1(C)OC(C)(C)C(=O)OC1=O- InChIKey
CGVYQNFYKAABLQ-UHFFFAOYSA-N- Molecular formula
- C8H12O4
- Average molar mass
- 172.18 g/mol
- Monoisotopic mass
- 172.07355886
Names & identifiers
- Preferred name
- Tetramethyl-1,4-dioxane-2,6-dione
- IUPAC
- 3,3,5,5-tetramethyl-1,4-dioxane-2,6-dione
Names & synonyms
tetramethyl-1,4-dioxane-2,6-dione58607-24-2RefChem:897318889-074-0tetramethyl-[1,4]dioxane-2,6-dione3,3,5,5-tetramethyl-1,4-dioxane-2,6-dioneICA60724EN300-249032
Database identifiers
- CAS
58607-24-2- PubChem CID
- 12282984
- EC Number
- 889-074-0
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 215
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
H227 (100%): Combustible liquid [Warning Flammable liquids]
P210, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, 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 CategoriesFlam. Liq. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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