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Home > Boronic Acids > 2246779-56-4
2246779-56-4 | 1,3,2-Dioxaborolane, 2-[3-[(3,4-dichlorophenyl)methoxy]phenyl]-4,4,5,5-tetramethyl-
CAS No: 2246779-56-4 Catalog No: AG01FFXU MDL No:
Product Description
Catalog Number:
AG01FFXU
Chemical Name:
1,3,2-Dioxaborolane, 2-[3-[(3,4-dichlorophenyl)methoxy]phenyl]-4,4,5,5-tetramethyl-
CAS Number:
2246779-56-4
Molecular Formula:
C19H21BCl2O3
Molecular Weight:
379.0852
IUPAC Name:
2-[3-[(3,4-dichlorophenyl)methoxy]phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C19H21BCl2O3/c1-18(2)19(3,4)25-20(24-18)14-6-5-7-15(11-14)23-12-13-8-9-16(21)17(22)10-13/h5-11H,12H2,1-4H3
InChI Key:
JXASGTYWJGICQR-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1Cl)COc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
444
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.096g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
379.084g/mol
Monoisotopic Mass:
378.096g/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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