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The molecular formula is C14H23BF3NO4.
The PubChem CID is 72662688.
The molecular weight is 337.14 g/mol.
The IUPAC name is 2,2,2-trifluoroacetic acid;1-(2,9,9-trimethyl-3,5-dioxa-4-boratricyclo[6.1.1.0 2,6 ]decan-4-yl)ethanamine.
The InChI is InChI=1S/C12H22BNO2.C2HF3O2/c1-7(14)13-15-10-6-8-5-9(11(8,2)3)12(10,4)16-13;3-2(4,5)1(6)7/h7-10H,5-6,14H2,1-4H3;(H,6,7).
The InChIKey is UIRPOZKMSMHJBQ-UHFFFAOYSA-N.
The canonical SMILES is B1(OC2CC3CC(C3(C)C)C2(O1)C)C(C)N.C(=O)(C(F)(F)F)O.
It has 2 hydrogen bond donor counts.
It has 8 hydrogen bond acceptor counts.
It has 1 rotatable bond count.
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