1072951-67-7
4-[(4-TERT-BUTYL-2-METHYLPHENOXY)METHYL]PHENYLBORONIC ACID
Name4-[(4-TERT-BUTYL-2-METHYLPHENOXY)METHYL]PHENYLBORONIC ACID
1Identification
【Name】
4-[(4-TERT-BUTYL-2-METHYLPHENOXY)METHYL]PHENYLBORONIC ACID
【CAS】
【MDL】
MFCD09265139
【English Synonyms】
【Formula】
C18 H23 B O3
【MolWeight】
298.188
【Inchi】
InChI=1S/C18H23BO3/c1-13-11-15(18(2,3)4)7-10-17(13)22-12-14-5-8-16(9-6-14)19(20)21/h5-11,20-21H,12H2,1-4H3
【InChIKey】
InChIKey=OPUGDQNAZFDADD-UHFFFAOYSA-N
【SMILES】
B(c1ccc(cc1)COc2ccc(cc2C)C(C)(C)C)(O)O
【MOL File】
4-[(4-TERT-BUTYL-2-M….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:3
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
【WGK Germany】
3
4CML File
4-[(4-TERT-BUTYL-2-METHYLPHENOXY)METHYL]PHENYLBORONIC ACID.cml