Basic information
- CAS
51555-36-3- Standard SMILES
C=C(C)C(=O)OC.C=C(C)C(C)=O- InChIKey
ZOZDQNWSAACOOL-UHFFFAOYSA-N- Molecular formula
- C10H16O3
- Average molar mass
- 184.23 g/mol
- Monoisotopic mass
- 184.10994437
Names & identifiers
- Preferred name
- CID 40057
- IUPAC
- 3-methylbut-3-en-2-one;methyl 2-methylprop-2-enoate
Names & synonyms
51555-36-3DTXSID209658843-methylbut-3-en-2-one;methyl 2-methylprop-2-enoateMethyl 2-methylprop-2-enoate--3-methylbut-3-en-2-one (1/1)
Database identifiers
- CAS
51555-36-3- PubChem CID
- 40057
- DTXSID
DTXSID20965884
Properties
Computed structural properties
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 176
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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