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Home > Boronic Acids > 1220219-36-2
1220219-36-2 | Cyclopropanemethanol, 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-
CAS No: 1220219-36-2 Catalog No: AG0016N4 MDL No:MFCD18383801
Product Description
Catalog Number:
AG0016N4
Chemical Name:
Cyclopropanemethanol, 1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-
CAS Number:
1220219-36-2
Molecular Formula:
C16H23BO3
Molecular Weight:
274.1630
MDL Number:
MFCD18383801
IUPAC Name:
[1-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]cyclopropyl]methanol
InChI:
InChI=1S/C16H23BO3/c1-14(2)15(3,4)20-17(19-14)13-7-5-12(6-8-13)16(11-18)9-10-16/h5-8,18H,9-11H2,1-4H3
InChI Key:
WLKBNPVGNWGUSP-UHFFFAOYSA-N
SMILES:
OCC1(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
352
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:
1
Isotope Atom Count:
0
Molecular Weight:
274.167g/mol
Monoisotopic Mass:
274.174g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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