Basic information
- CAS
23693-82-5- Standard SMILES
CCCOC(=O)CCN1CC1- InChIKey
VTWAWMLOUJACQE-UHFFFAOYSA-N- Molecular formula
- C8H15NO2
- Average molar mass
- 157.21 g/mol
- Monoisotopic mass
- 157.11027872
Names & identifiers
- Preferred name
- 1-Aziridinepropionic acid, propyl ester
- IUPAC
- propyl 3-(aziridin-1-yl)propanoate
Names & synonyms
1-AZIRIDINEPROPIONIC ACID, PROPYL ESTER1-Aziridinepropanoic acid, propyl ester23693-82-5DTXSID40178358RefChem:227755DTXCID70100849propyl 3-(aziridin-1-yl)propanoateSCHEMBL674334
Database identifiers
- CAS
23693-82-5- PubChem CID
- 32039
- DTXSID
DTXSID40178358- Nikkaji
- J84.764J
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 132
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…