Basic information
- CAS
5471-53-4- Standard SMILES
COC(=O)CCCN1CCOCC1- InChIKey
QZYHXBPEHSABEW-UHFFFAOYSA-N- Molecular formula
- C9H17NO3
- Average molar mass
- 187.24 g/mol
- Monoisotopic mass
- 187.1208434
Names & identifiers
- Preferred name
- Methyl 4-morpholinobutanoate
- IUPAC
- methyl 4-morpholin-4-ylbutanoate
Names & synonyms
methyl 4-morpholinobutanoate5471-53-4methyl 4-(morpholin-4-yl)butanoatemethyl 4-morpholin-4-ylbutanoateMethyl 4-(4-morpholinyl)butanoateNSC26584starbld0044314Methyl gamma-morpholinobutyrateSCHEMBL6956312SCHEMBL9676717CHEMBL1193198SCHEMBL11738960
Show more names
DTXSID60275474QZYHXBPEHSABEW-UHFFFAOYSA-NBBL011899MFCD11868659NSC-26584AKOS000113939VS-03108CS-0117921
Database identifiers
- CAS
5471-53-4- PubChem CID
- 44858
- DTXSID
DTXSID60275474- ChEMBL
CHEMBL1193198- Nikkaji
- J1.773.338I
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 155
Related reactions
5 records
Compound notes
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