Morpholine, 4-[2-[(phenylmethyl)sulfonyl]ethyl]-
Basic information
- CAS
100619-37-2- Standard SMILES
O=S(=O)(CCN1CCOCC1)Cc1ccccc1- InChIKey
VAHDKWJEMQCXKU-UHFFFAOYSA-N- Molecular formula
- C13H19NO3S
- Average molar mass
- 269.36 g/mol
- Monoisotopic mass
- 269.10856464
Names & identifiers
- Preferred name
- Morpholine, 4-[2-[(phenylmethyl)sulfonyl]ethyl]-
- IUPAC
- 4-(2-benzylsulfonylethyl)morpholine
Names & synonyms
100619-37-2Morpholine, 4-[2-[(phenylmethyl)sulfonyl]ethyl]-4-[2-(Phenylmethanesulfonyl)ethyl]morpholineDTXSID70555032
Database identifiers
- CAS
100619-37-2- PubChem CID
- 14048366
- DTXSID
DTXSID70555032
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 55 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 325
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Related reactions
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Compound notes
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