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Home > Boronic Acids > 942070-16-8
942070-16-8 | 2,2'-(5-CHLOROTHIOPHENE-2,4-DIYL)BIS(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE)
CAS No: 942070-16-8 Catalog No: AG006OD3 MDL No:MFCD12407252
Product Description
Catalog Number:
AG006OD3
Chemical Name:
2,2'-(5-CHLOROTHIOPHENE-2,4-DIYL)BIS(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE)
CAS Number:
942070-16-8
Molecular Formula:
C16H25B2ClO4S
Molecular Weight:
370.5073
MDL Number:
MFCD12407252
IUPAC Name:
2-[2-chloro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)thiophen-3-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C16H25B2ClO4S/c1-13(2)14(3,4)21-17(20-13)10-9-11(24-12(10)19)18-22-15(5,6)16(7,8)23-18/h9H,1-8H3
InChI Key:
CTQFFZXZJQGQAG-UHFFFAOYSA-N
SMILES:
Clc1sc(cc1B1OC(C(O1)(C)C)(C)C)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
482
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.135g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.502g/mol
Monoisotopic Mass:
370.135g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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