Methyl 3-ethylideneazetidine-1-carboxylate
Basic information
- CAS
118973-04-9- Standard SMILES
CC=C1CN(C(=O)OC)C1- InChIKey
RPXZKHUUGLVPIS-UHFFFAOYSA-N- Molecular formula
- C7H11NO2
- Average molar mass
- 141.17 g/mol
Names & identifiers
- Preferred name
- Methyl 3-ethylideneazetidine-1-carboxylate
- IUPAC
- methyl 3-ethylideneazetidine-1-carboxylate
- English name
- 1-Azetidinecarboxylicacid,3-ethylidene-,methylester(9CI)
- Molecular formula
- C7H11NO2
- Molecular weight
- 141.17
Names & synonyms
Methyl 3-ethylideneazetidine-1-carboxylate118973-04-91-Azetidinecarboxylicacid,3-ethylidene-,methylester(9CI)1-Azetidinecarboxylic acid, 3-ethylidene-, methyl ester
Database identifiers
- CAS
118973-04-9
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 166
Physicochemical properties
- Boiling point
- 191.8 · 191.8±29.0 °C(Predicted)
- Density
- 1 · 1+-.0.06 g/cm3(Predicted)
- pka
- -1.49 · -1.49±0.20(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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