Products 543910-55-0

CAS 543910-55-0 is the registry number for tert-Butyl (3aR,4S,7aR)-4-hydroxy-4-(m-tolylethynyl)octahydro-1H-indole-1-carboxylate, 98%. Offered by: Chemat Brand. Available pack sizes: on request.

Structural formula: {0} (CAS {1})

Tert-butyl (3aR,4S,7aR)-4-hydroxy-4-[2-(3-methylphenyl)ethynyl]-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylate (CAS 543910-55-0) is a chemical compound with the molecular formula C22H29NO3 and a molecular weight of 355.5 g/mol. IUPAC name: tert-butyl (3aR,4S,7aR)-4-hydroxy-4-[2-(3-methylphenyl)ethynyl]-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylate. InChIKey: ZAPZZFRGOMWRCG-WOIUINJBSA-N.

Identity
Molecular formulaC22H29NO3
Molecular weight355.5 g/mol
IUPAC nametert-butyl (3aR,4S,7aR)-4-hydroxy-4-[2-(3-methylphenyl)ethynyl]-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylate
InChIKeyZAPZZFRGOMWRCG-WOIUINJBSA-N
SMILESCC1=CC(=CC=C1)C#C[C@@]2(CCC[C@@H]3[C@H]2CCN3C(=O)OC(C)(C)C)O

Computed by PubChem (NCBI)