929899-20-7
METHYL 1-METHYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE-5-CARBOXYLATE
NameMETHYL 1-METHYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE-5-CARBOXYLATE
1Identification
【Name】
METHYL 1-METHYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE-5-CARBOXYLATE
【CAS】
【MDL】
MFCD16995823
【English Synonyms】
【Formula】
C12 H19 B N2 O4
【MolWeight】
266.103
【Inchi】
InChI=1S/C12H19BN2O4/c1-11(2)12(3,4)19-13(18-11)9-7-8(10(16)17-6)15(5)14-9/h7H,1-6H3
【InChIKey】
InChIKey=WCOQTWMJQDTQJX-UHFFFAOYSA-N
【SMILES】
B1(OC(C(O1)(C)C)(C)C)c2cc(n(n2)C)C(=O)OC
【MOL File】
METHYL 1-METHYL-3-(4….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
METHYL 1-METHYL-3-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLE-5-CARBOXYLATE.cml