915402-05-0
4,4,5,5-TETRAMETHYL-2-(4-CYCLOPROPYLCARBONYLPHENYL)-[1,3,2]DIOXABOROLANE
Name4,4,5,5-TETRAMETHYL-2-(4-CYCLOPROPYLCARBONYLPHENYL)-[1,3,2]DIOXABOROLANE
1Identification
【Name】
4,4,5,5-TETRAMETHYL-2-(4-CYCLOPROPYLCARBONYLPHENYL)-[1,3,2]DIOXABOROLANE
【CAS】
【MDL】
MFCD08706295
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C16 H21 B O3
【pro_molWeight】
272.15
【Inchi】
InChI=1S/C16H21BO3/c1-15(2)16(3,4)20-17(19-15)13-9-7-12(8-10-13)14(18)11-5-6-11/h7-11H,5-6H2,1-4H3
【InChIKey】
InChIKey=TXKSCAGVSMSVQZ-UHFFFAOYSA-N
【SMILES】
B1(OC(C(O1)(C)C)(C)C)c2ccc(cc2)C(=O)C3CC3
【MOL File】
4,4,5,5-TETRAMETHYL-….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
4,4,5,5-TETRAMETHYL-2-(4-CYCLOPROPYLCARBONYLPHENYL)-[1,3,2]DIOXABOROLANE.cml