Basic information
- CAS
101550-37-2- Standard SMILES
C=CC(=O)NC(C)(C)C.C=CC(=O)O- InChIKey
CPYYIXVRFJAIFK-UHFFFAOYSA-N- Molecular formula
- C10H17NO3
- Average molar mass
- 199.25 g/mol
- Monoisotopic mass
- 199.1208434
Names & identifiers
- Preferred name
- Prop-2-enoic acid--N-tert-butylprop-2-enimidic acid (1/1)
- IUPAC
- N-tert-butylprop-2-enamide;prop-2-enoic acid
Names & synonyms
SCHEMBL859634DTXSID40906310Prop-2-enoic acid--N-tert-butylprop-2-enimidic acid (1/1)
Database identifiers
- CAS
101550-37-2- PubChem CID
- 44145643
- DTXSID
DTXSID40906310
Properties
Computed structural properties
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 177
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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