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Home > Boronic Acids > 1256360-25-4
1256360-25-4 | 2-(3-Methoxy-5-(methylthio)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS No: 1256360-25-4 Catalog No: AG009BR1 MDL No:MFCD16618974
Product Description
Catalog Number:
AG009BR1
Chemical Name:
2-(3-Methoxy-5-(methylthio)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CAS Number:
1256360-25-4
Molecular Formula:
C14H21BO3S
Molecular Weight:
280.1907
MDL Number:
MFCD16618974
IUPAC Name:
2-(3-methoxy-5-methylsulfanylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C14H21BO3S/c1-13(2)14(3,4)18-15(17-13)10-7-11(16-5)9-12(8-10)19-6/h7-9H,1-6H3
InChI Key:
BBSUWBVUXWRNDY-UHFFFAOYSA-N
SMILES:
COc1cc(SC)cc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.13g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.189g/mol
Monoisotopic Mass:
280.13g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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