1158680-97-7
1-(3-METHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-INDAZOL-1-YL)ETHANONE
Name1-(3-METHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-INDAZOL-1-YL)ETHANONE
1Identification
【Name】
1-(3-METHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-INDAZOL-1-YL)ETHANONE
【CAS】
【MDL】
MFCD16995864
【English Synonyms】
【Formula】
C16 H21 B N2 O3
【MolWeight】
300.164
【Inchi】
InChI=1S/C16H21BN2O3/c1-10-13-9-12(7-8-14(13)19(18-10)11(2)20)17-21-15(3,4)16(5,6)22-17/h7-9H,1-6H3
【InChIKey】
InChIKey=DHYSFIBCSKKIMB-UHFFFAOYSA-N
【SMILES】
B1(OC(C(O1)(C)C)(C)C)c2ccc3c(c2)c(nn3C(=O)C)C
【MOL File】
1-(3-METHYL-5-(4,4,5….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1-(3-METHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-INDAZOL-1-YL)ETHANONE.cml