4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,8,8-trimethyl-α-(2-methylpropyl)-, (αR,3aS,4S,6S,7aR)-, 2,2,2-trifluoroacetate (1:1)

CAS Registry Number®

179324-87-9

CAS Name

4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,8,8-trimethyl-α-(2-methylpropyl)-, (αR,3aS,4S,6S,7aR)-, 2,2,2-trifluoroacetate (1:1)

Molecular Formula

C15H28BNO2.C2HF3O2

Molecular Mass

379.22

Cite this Page

4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,8,8-trimethyl-α-(2-methylpropyl)-, (αR,3aS,4S,6S,7aR)-, 2,2,2-trifluoroacetate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=179324-87-9 (retrieved 2025-04-15) (CAS RN: 179324-87-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    197-198 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C15H28BNO2.C2HF3O2/c1-9(2)6-13(17)16-18-12-8-10-7-11(14(10,3)4)15(12,5)19-16;3-2(4,5)1(6)7/h9-13H,6-8,17H2,1-5H3;(H,6,7)/t10-,11-,12+,13-,15-;/m0./s1

InChIKey

InChIKey=SRFQKJZNJYTMNI-CDVUYJLHSA-N

SMILES

C[C@]12[C@@]3(C(C)(C)[C@@](C3)(C[C@]1(OB([C@H](CC(C)C)N)O2)[H])[H])[H].C(C(O)=O)(F)(F)F

Canonical SMILES

O=C(O)C(F)(F)F.O1B(OC2(C)C1CC3CC2C3(C)C)C(N)CC(C)C

Other Names for this Substance

  • 4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,8,8-trimethyl-α-(2-methylpropyl)-, (αR,3aS,4S,6S,7aR)-, 2,2,2-trifluoroacetate (1:1)
  • 4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,5,5-trimethyl-α-(2-methylpropyl)-, [3aS-[2(S*),3aα,4β,6β,7aα]]-, trifluoroacetate
  • 4,6-Methano-1,3,2-benzodioxaborole-2-methanamine, hexahydro-3a,5,5-trimethyl-α-(2-methylpropyl)-, (αR,3aS,4S,6S,7aR)-, trifluoroacetate

CAS INSIGHTSTM
Cell Membrane Phospholipid Structure,Phospholipid bilayer of the cell membrane, Lipid bilayer