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Home > Boronic Acids > 1207961-49-6
1207961-49-6 | 2-(4-chloro-2-methoxy-6-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 1207961-49-6 Catalog No: AG00HFRA MDL No:MFCD18383892
Product Description
Catalog Number:
AG00HFRA
Chemical Name:
2-(4-chloro-2-methoxy-6-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
1207961-49-6
Molecular Formula:
C14H20BClO3
Molecular Weight:
282.5708
MDL Number:
MFCD18383892
IUPAC Name:
2-(4-chloro-2-methoxy-6-methylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C14H20BClO3/c1-9-7-10(16)8-11(17-6)12(9)15-18-13(2,3)14(4,5)19-15/h7-8H,1-6H3
InChI Key:
KGUUEDHYGGLXHK-UHFFFAOYSA-N
SMILES:
COc1cc(Cl)cc(c1B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
319
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.119g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.571g/mol
Monoisotopic Mass:
282.119g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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