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Home > Boronic Acids > 1185836-98-9
1185836-98-9 | 2-CyclopropylMethoxyphenylboronic acid pinacol ester
CAS No: 1185836-98-9 Catalog No: AG008UC5 MDL No:MFCD13152006
Product Description
Catalog Number:
AG008UC5
Chemical Name:
2-CyclopropylMethoxyphenylboronic acid pinacol ester
CAS Number:
1185836-98-9
Molecular Formula:
C16H23BO3
Molecular Weight:
274.1630
MDL Number:
MFCD13152006
IUPAC Name:
2-[2-(cyclopropylmethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C16H23BO3/c1-15(2)16(3,4)20-17(19-15)13-7-5-6-8-14(13)18-11-12-9-10-12/h5-8,12H,9-11H2,1-4H3
InChI Key:
VQJIGAHQIKKQPK-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccccc1OCC1CC1
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.174g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.167g/mol
Monoisotopic Mass:
274.174g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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