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Home > Boronic Acids > 1218789-78-6

1218789-78-6

1218789-78-6 | 1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-[3-methyl-5-(2-methylpropoxy)phenyl]-

CAS No: 1218789-78-6 Catalog No: AG00168F MDL No:MFCD12546603

Product Description

Catalog Number:
AG00168F
Chemical Name:
1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-[3-methyl-5-(2-methylpropoxy)phenyl]-
CAS Number:
1218789-78-6
Molecular Formula:
C17H27BO3
Molecular Weight:
290.2055
MDL Number:
MFCD12546603
IUPAC Name:
4,4,5,5-tetramethyl-2-[3-methyl-5-(2-methylpropoxy)phenyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C17H27BO3/c1-12(2)11-19-15-9-13(3)8-14(10-15)18-20-16(4,5)17(6,7)21-18/h8-10,12H,11H2,1-7H3
InChI Key:
UDSMETWQXRTDFS-UHFFFAOYSA-N
SMILES:
CC(COc1cc(C)cc(c1)B1OC(C(O1)(C)C)(C)C)C

Properties

Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.205g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.21g/mol
Monoisotopic Mass:
290.205g/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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