885044-50-8
3-ACETAMIDO-5-TRIFLUOROMETHYLPHENYLBORONIC ACID, PINACOL ESTER
Name
3-ACETAMIDO-5-TRIFLUOROMETHYLPHENYLBORONIC ACID, PINACOL ESTER
Formula
C15 H19 B F3 N O3
MolWeight
329.124
1Identification
【Name】
3-ACETAMIDO-5-TRIFLUOROMETHYLPHENYLBORONIC ACID, PINACOL ESTER
【CAS】
【MDL】
MFCD12923180
【English Synonyms】
【Formula】
C15 H19 B F3 N O3
【MolWeight】
329.124
【Inchi】
InChI=1S/C15H19BF3NO3/c1-9(21)20-12-7-10(15(17,18)19)6-11(8-12)16-22-13(2,3)14(4,5)23-16/h6-8H,1-5H3,(H,20,21)
【InChIKey】
InChIKey=YMUFDFRNXHUJLZ-UHFFFAOYSA-N
【SMILES】
B1(OC(C(O1)(C)C)(C)C)c2cc(cc(c2)NC(=O)C)C(F)(F)F
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-ACETAMIDO-5-TRIFLUOROMETHYLPHENYLBORONIC ACID, PINACOL ESTER.cml
Quick Release
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