1-(Aziridin-1-yl)but-3-en-2-yl ethyl carbonate
Basic information
- CAS
5110-72-5- Standard SMILES
C=CC(CN1CC1)OC(=O)OCC- InChIKey
GDURJHKNWPUYPI-UHFFFAOYSA-N- Molecular formula
- C9H15NO3
- Average molar mass
- 185.22 g/mol
- Monoisotopic mass
- 185.10519334
Names & identifiers
- Preferred name
- 1-(Aziridin-1-yl)but-3-en-2-yl ethyl carbonate
- IUPAC
- 1-(aziridin-1-yl)but-3-en-2-yl ethyl carbonate
Names & synonyms
5110-72-51-(aziridin-1-yl)but-3-en-2-yl ethyl carbonateNSC528722DTXSID80326472NSC-528722
Database identifiers
- CAS
5110-72-5- PubChem CID
- 352898
- DTXSID
DTXSID80326472
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 38.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 189
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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