Basic information
- CAS
22480-24-6- Standard SMILES
CCCCOC(=O)CCN1CC1- InChIKey
BJRXXRRJKPBDKK-UHFFFAOYSA-N- Molecular formula
- C9H17NO2
- Average molar mass
- 171.24 g/mol
- Monoisotopic mass
- 171.12592879
Names & identifiers
- Preferred name
- Butyl 3-(aziridin-1-yl)propanoate
- IUPAC
- butyl 3-(aziridin-1-yl)propanoate
Names & synonyms
22480-24-6butyl 3-(aziridin-1-yl)propanoateNSC101279NCIOpen2_001791SCHEMBL673095DTXSID40295332NSC-101279
Database identifiers
- CAS
22480-24-6- PubChem CID
- 265367
- DTXSID
DTXSID40295332
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 143
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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