1,4,4-Trimethyl-2-oxopyrrolidin-3-yl prop-2-enoate
Basic information
- CAS
737762-15-1- Standard SMILES
C=CC(=O)OC1C(=O)N(C)CC1(C)C- InChIKey
KTKNYJTVFGLKAN-UHFFFAOYSA-N- Molecular formula
- C10H15NO3
- Average molar mass
- 197.23 g/mol
- Monoisotopic mass
- 197.10519334
Names & identifiers
- Preferred name
- 1,4,4-Trimethyl-2-oxopyrrolidin-3-yl prop-2-enoate
- IUPAC
- (1,4,4-trimethyl-2-oxopyrrolidin-3-yl) prop-2-enoate
- English name
- 2-Propenoicacid,1,4,4-trimethyl-2-oxo-3-pyrrolidinylester(9CI)
- Molecular formula
- C10H15NO3
- Molecular weight
- 197.23
Names & synonyms
737762-15-11,4,4-Trimethyl-2-oxopyrrolidin-3-yl prop-2-enoateDTXSID904615852-Propenoic acid, 1,4,4-trimethyl-2-oxo-3-pyrrolidinyl ester2-Propenoicacid,1,4,4-trimethyl-2-oxo-3-pyrrolidinylester(9CI)
Database identifiers
- CAS
737762-15-1- PubChem CID
- 11298541
- DTXSID
DTXSID90461585- Nikkaji
- J2.126.807K
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 283
Physicochemical properties
- Melting point
- 70 · 70-72 °C
- Boiling point
- 290.4 · 290.4±33.0 °C(Predicted)
- Density
- 1.1 · 1.10±0.1 g/cm3(Predicted)
- pka
- -2.47 · -2.47±0.60(Predicted)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…