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Home > Boronic Acids > 596819-12-4
596819-12-4 | 5-METHOXYTHIOPHENE-2-BORONIC ACID PINACOL ESTER
CAS No: 596819-12-4 Catalog No: AG00EEHI MDL No:MFCD09952065
Product Description
Catalog Number:
AG00EEHI
Chemical Name:
5-METHOXYTHIOPHENE-2-BORONIC ACID PINACOL ESTER
CAS Number:
596819-12-4
Molecular Formula:
C11H17BO3S
Molecular Weight:
240.1269
MDL Number:
MFCD09952065
IUPAC Name:
2-(5-methoxythiophen-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C11H17BO3S/c1-10(2)11(3,4)15-12(14-10)8-6-7-9(13-5)16-8/h6-7H,1-5H3
InChI Key:
WAUOLRNNTGNWJP-UHFFFAOYSA-N
SMILES:
COc1ccc(s1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.099g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.124g/mol
Monoisotopic Mass:
240.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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