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Basic information
- CAS
6498-80-2- Standard SMILES
CCCC(=O)OCCN1CC1- InChIKey
FBAYMBYTQSRULB-UHFFFAOYSA-N- Molecular formula
- C8H15NO2
- Average molar mass
- 157.21 g/mol
- Monoisotopic mass
- 157.11027872
Names & identifiers
- Preferred name
- 2-(Aziridin-1-yl)ethyl butanoate
- IUPAC
- 2-(aziridin-1-yl)ethyl butanoate
- English name
- 2-aziridin-1-ylethyl butanoate
- Molecular formula
- C8H15NO2
- Molecular weight
- 157.21
Names & synonyms
2-(aziridin-1-yl)ethyl butanoate6498-80-22-(Aziridin-1-yl)ethyl butyrateNSC52377Butanoic acid,2-(1-aziridinyl)ethyl esterDTXSID60287754NSC-52377DS-0105772-aziridin-1-ylethyl butanoateButanoic acid, 2-(1-aziridinyl)ethyl ester
Database identifiers
- CAS
6498-80-2- PubChem CID
- 243131
- DTXSID
DTXSID60287754
Properties
Computed structural propertiesFilling in
- 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
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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