1268340-97-1
(4-BOC-1-PIPERAZINIUM-1-YLMETHYL)TRIFLUOROBORATE INTERNAL SALT
Name(4-BOC-1-PIPERAZINIUM-1-YLMETHYL)TRIFLUOROBORATE INTERNAL SALT
FormulaC10 H20 B F3 N2 O2
1Identification
【Name】
(4-BOC-1-PIPERAZINIUM-1-YLMETHYL)TRIFLUOROBORATE INTERNAL SALT
【CAS】
【MDL】
MFCD20134170
【English Synonyms】
【Formula】
C10 H20 B F3 N2 O2
【MolWeight】
268.085
【Inchi】
InChI=1S/C10H19BF3N2O2/c1-10(2,3)18-9(17)16-6-4-15(5-7-16)8-11(12,13)14/h4-8H2,1-3H3/q-1/p+1
【InChIKey】
InChIKey=ZMODHXXZBLTZED-UHFFFAOYSA-O
【SMILES】
[B-](C[NH+]1CCN(CC1)C(=O)OC(C)(C)C)(F)(F)F
【MOL File】
(4-BOC-1-PIPERAZINIU….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(4-BOC-1-PIPERAZINIUM-1-YLMETHYL)TRIFLUOROBORATE INTERNAL SALT.cml