2-(Morpholin-4-ylmethyl)oxane-2,3,4,5-tetrol

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Basic information

CAS: 54917-62-3
Standard SMILES: OC1COC(O)(CN2CCOCC2)C(O)C1O
InChIKey: ATMWVQZPUIFAQM-UHFFFAOYSA-N
Molecular formula: C10H19NO6
Average molar mass: 249.26 g/mol
Monoisotopic mass: 249.12123733

Names & identifiers

Preferred name: 2-(Morpholin-4-ylmethyl)oxane-2,3,4,5-tetrol
IUPAC: 2-(morpholin-4-ylmethyl)oxane-2,3,4,5-tetrol

Names & synonyms

2-(morpholin-4-ylmethyl)oxane-2,3,4,5-tetrolDTXSID7031989854917-62-3RefChem:254410DTXCID50271021NSC351577Oprea1_150617.beta.-D-Fructopyranose, 1-deoxy-1-(4-morpholinyl)-NSC-3515771-Deoxy-1-(morpholin-4-yl)hex-2-ulopyranose

Database identifiers

CAS: 54917-62-3
PubChem CID: 336649
DTXSID: DTXSID70319898

Properties

Computed structural properties

XLogP: -3
Topological polar surface area: 103 Å²
Hydrogen bond donors: 4
Hydrogen bond acceptors: 7
Rotatable bonds: 2
Heavy atoms: 17
Formal charge: 0
Complexity: 259

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