Synonyms
815581-79-4; MFCD27977084; {2-[(2,2,6,6-tetramethylpiperidin-1-yl)methyl]phenyl}boronic acid; 2-[(2,2,6,6-Tetramethyl-1-piperidyl)methyl]phenylboronic Acid (contains varying amounts of Anhydride); ZINC195922003;
IUPAC Name
[2-[(2,2,6,6-tetramethylpiperidin-1-yl)methyl]phenyl]boronic acid;
Molecular Weight
275.199g/mol
Molecular Formula
C16H26BNO2;
Canonical SMILES
B(C1=CC=CC=C1CN2C(CCCC2(C)C)(C)C)(O)O;
InChI
InChI=1S/C16H26BNO2/c1-15(2)10-7-11-16(3,4)18(15)12-13-8-5-6-9-14(13)17(19)20/h5-6,8-9,19-20H,7,10-12H2,1-4H3;
InChI Key
DOZVPMCVRDTTJK-UHFFFAOYSA-N;
Complexity
314
Covalently-Bonded Unit Count
1
Exact Mass
275.206g/mol
H-Bond Acceptor
3
H-Bond Donor
2
Heavy Atom Count
20
Monoisotopic Mass
275.206g/mol
Rotatable Bond Count
3
Topological Polar Surface Area
43.7A^2
