Basic information
- Standard SMILES
C=CC(=O)OCCC(=O)N1CC1C- InChIKey
NBSMOJFYJQJYHJ-UHFFFAOYSA-N- Molecular formula
- C9H13NO3
- Average molar mass
- 183.2 g/mol
Names & identifiers
- Preferred name
- Acrylic acid-3-(2-methylaziridin-1yl)-3-oxopropyl ester
- IUPAC
- [3-(2-methylaziridin-1-yl)-3-oxopropyl] prop-2-enoate
Names & synonyms
SCHEMBL33471NBSMOJFYJQJYHJ-UHFFFAOYSA-Nacrylic acid-3-(2-methylaziridin-1yl)-3-oxopropyl ester
Database identifiers
- PubChem CID
- 58070545
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 46.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 237
Related reactions
2 records
Compound notes
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