Basic information
- CAS
23693-84-7- Standard SMILES
CCC(C)OC(=O)CCN1CC1- InChIKey
ZGEDPDWIZTXRJQ-UHFFFAOYSA-N- Molecular formula
- C9H17NO2
- Average molar mass
- 171.24 g/mol
- Monoisotopic mass
- 171.12592879
Names & identifiers
- Preferred name
- 1-Aziridinepropionic acid, sec-butyl ester
- IUPAC
- butan-2-yl 3-(aziridin-1-yl)propanoate
Names & synonyms
1-AZIRIDINEPROPIONIC ACID, sec-BUTYL ESTER23693-84-7RefChem:1054900butan-2-yl 3-(aziridin-1-yl)propanoateAziridine propionic acid, sec-butyl ester1-Aziridinepropanoic acid, sec-butyl esterDTXSID20946496
Database identifiers
- CAS
23693-84-7- PubChem CID
- 32041
- DTXSID
DTXSID20946496- Nikkaji
- J84.744E
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 29.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 155
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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