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Home > Boronic Acids > 239075-02-6
239075-02-6 | 5,5'-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,2'-bithiophene
CAS No: 239075-02-6 Catalog No: AG003M8S MDL No:MFCD06798112
Product Description
Catalog Number:
AG003M8S
Chemical Name:
5,5'-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,2'-bithiophene
CAS Number:
239075-02-6
Molecular Formula:
C20H28B2O4S2
Molecular Weight:
418.1859
MDL Number:
MFCD06798112
IUPAC Name:
4,4,5,5-tetramethyl-2-[5-[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-2-yl]thiophen-2-yl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C20H28B2O4S2/c1-17(2)18(3,4)24-21(23-17)15-11-9-13(27-15)14-10-12-16(28-14)22-25-19(5,6)20(7,8)26-22/h9-12H,1-8H3
InChI Key:
XWWXVHGWYCXJCJ-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(s1)c1ccc(s1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
529
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
418.162g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
418.18g/mol
Monoisotopic Mass:
418.162g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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