Cas no 312639-52-4 ((3R,4aS,8aS)-N-Boc-decahydroisoQuinoline-3-carboxylic acid)

(3R,4aS,8aS)-N-Boc-decahydroisoQuinoline-3-carboxylic acid structure
312639-52-4 structure
Product Name:(3R,4aS,8aS)-N-Boc-decahydroisoQuinoline-3-carboxylic acid
CAS No:312639-52-4
MF:C15H25NO4
MW:283.363304853439
CID:1110682
Update Time:2024-07-24

(3R,4aS,8aS)-N-Boc-decahydroisoQuinoline-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • (3R,4aS,8aS)-N-Boc-decahydroisoQuinoline-3-carboxylic acid
    • 2,3(1H)-Isoquinolinedicarboxylic acid, octahydro-, 2-(1,1-dimethylethyl) ester, (3R,4aS,8aS)-
    • Inchi: 1S/C15H25NO4/c1-15(2,3)20-14(19)16-9-11-7-5-4-6-10(11)8-12(16)13(17)18/h10-12H,4-9H2,1-3H3,(H,17,18)/t10-,11+,12+/m0/s1
    • InChI Key: WWTFZHGXVCAEKT-QJPTWQEYSA-N
    • SMILES: C1[C@]2([H])[C@@]([H])(CCCC2)C[C@H](C(O)=O)N1C(OC(C)(C)C)=O

Experimental Properties

  • Density: 1.138±0.06 g/cm3(Predicted)
  • Boiling Point: 415.5±28.0 °C(Predicted)
  • pka: 4.04±0.20(Predicted)
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