1-(Butylamino)-1-oxopropan-2-yl acetate
Basic information
- CAS
6306-06-5- Standard SMILES
CCCCNC(=O)C(C)OC(C)=O- InChIKey
WCNCPOAGGIARED-UHFFFAOYSA-N- Molecular formula
- C9H17NO3
- Average molar mass
- 187.24 g/mol
- Monoisotopic mass
- 187.1208434
Names & identifiers
- Preferred name
- 1-(Butylamino)-1-oxopropan-2-yl acetate
- IUPAC
- [1-(butylamino)-1-oxopropan-2-yl] acetate
- English name
- 1-(butylcarbamoyl)ethyl acetate
- Molecular formula
- C9H17NO3
- Molecular weight
- 0
Names & synonyms
6306-06-51-(butylamino)-1-oxopropan-2-yl acetateNSC22833DTXSID60281737NSC-228331-(butylcarbamoyl)ethyl acetate
Database identifiers
- CAS
6306-06-5- PubChem CID
- 229290
- DTXSID
DTXSID60281737
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 55.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 180
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Related reactions
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Compound notes
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