tert-butyl (3S)-6-hydroxy-3-(methylsulfonyloxymethyl)-2,3-dihydroindole-1-carboxylate

HCID 148103

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Basic information

CAS: 128049-51-4
Standard SMILES: CC(C)(C)OC(=O)N1C[C@@H](COS(C)(=O)=O)c2ccc(O)cc21
InChIKey: YBIFXPUUHIBODV-JTQLQIEISA-N
Molecular formula: C15H21NO6S
Average molar mass: 343.4 g/mol
Monoisotopic mass: 343.10895856

Names & identifiers

Preferred name: tert-butyl (3S)-6-hydroxy-3-(methylsulfonyloxymethyl)-2,3-dihydroindole-1-carboxylate
IUPAC: tert-butyl (3S)-6-hydroxy-3-(methylsulfonyloxymethyl)-2,3-dihydroindole-1-carboxylate
English name: tert-butyl (3S)-6-hydroxy-3-(methylsulfonyloxymethyl)-2,3-dihydroindol e-1-carboxylate
Molecular formula: C15H21NO6S
Molecular weight: 0

Names & synonyms

128049-51-4Seco-(+)-N-boc-citert-butyl (3S)-6-hydroxy-3-(methylsulfonyloxymethyl)-2,3-dihydroindole-1-carboxylatetert-butyl (3S)-6-hydroxy-3-(methylsulfonyloxymethyl)-2,3-dihydroindol e-1-carboxylate

Database identifiers

CAS: 128049-51-4
PubChem CID: 148103

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 102 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 5
Heavy atoms: 23
Formal charge: 0
Complexity: 535

Chemistry & industry

Suppliers1 total

HONEST JOY HOLDINGS LIMITED[email protected]

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