1173889-20-7
LITHIUM 2-HYDROXY-4,4,5,5-TETRAMETHYL-2-(1-METHYL-1H-PYRAZOL-4-YL)-1,3,2-DIOXABOROLAN-2-UIDE
NameLITHIUM 2-HYDROXY-4,4,5,5-TETRAMETHYL-2-(1-METHYL-1H-PYRAZOL-4-YL)-1,3,2-DIOXABOROLAN-2-UIDE
FormulaC10 H18 B N2 O3 . Li
1Identification
【Name】
LITHIUM 2-HYDROXY-4,4,5,5-TETRAMETHYL-2-(1-METHYL-1H-PYRAZOL-4-YL)-1,3,2-DIOXABOROLAN-2-UIDE
【CAS】
【MDL】
MFCD16987688
【English Synonyms】
【Formula】
C10 H18 B N2 O3 . Li
【MolWeight】
232.015
【Inchi】
InChI=1S/C10H18BN2O3.Li/c1-9(2)10(3,4)16-11(14,15-9)8-6-12-13(5)7-8;/h6-7,14H,1-5H3;/q-1;+1
【InChIKey】
InChIKey=YAGHQCJCHREQHW-UHFFFAOYSA-N
【SMILES】
[Li+].[B-]1(OC(C(O1)(C)C)(C)C)(c2cnn(c2)C)O
【MOL File】
LITHIUM 2-HYDROXY-4,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
LITHIUM 2-HYDROXY-4,4,5,5-TETRAMETHYL-2-(1-METHYL-1H-PYRAZOL-4-YL)-1,3,2-DIOXABOROLAN-2-UIDE.cml