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Home > Boronic Acids > 910553-12-7
910553-12-7 | 2-Methylthiophene-3-boronic acid pinacol ester
CAS No: 910553-12-7 Catalog No: AG00GT6P MDL No:MFCD09837623
Product Description
Catalog Number:
AG00GT6P
Chemical Name:
2-Methylthiophene-3-boronic acid pinacol ester
CAS Number:
910553-12-7
Molecular Formula:
C11H17BO2S
Molecular Weight:
224.1275
MDL Number:
MFCD09837623
IUPAC Name:
4,4,5,5-tetramethyl-2-(2-methylthiophen-3-yl)-1,3,2-dioxaborolane
InChI:
InChI=1S/C11H17BO2S/c1-8-9(6-7-15-8)12-13-10(2,3)11(4,5)14-12/h6-7H,1-5H3
InChI Key:
YCOQKTIMEQOYNN-UHFFFAOYSA-N
SMILES:
Cc1sccc1B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
239
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.104g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.125g/mol
Monoisotopic Mass:
224.104g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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