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459409-74-6 | 2-PHENYLTHIOPHENE-5-BORONIC ACID PINACOL ESTER
CAS No: 459409-74-6 Catalog No: AG00DAGL MDL No:MFCD08063141
Product Description
Catalog Number:
AG00DAGL
Chemical Name:
2-PHENYLTHIOPHENE-5-BORONIC ACID PINACOL ESTER
CAS Number:
459409-74-6
Molecular Formula:
C16H19BO2S
Molecular Weight:
286.1969
MDL Number:
MFCD08063141
IUPAC Name:
4,4,5,5-tetramethyl-2-(5-phenylthiophen-2-yl)-1,3,2-dioxaborolane
InChI:
InChI=1S/C16H19BO2S/c1-15(2)16(3,4)19-17(18-15)14-11-10-13(20-14)12-8-6-5-7-9-12/h5-11H,1-4H3
InChI Key:
BOTJOCNWKJVWRR-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(s1)c1ccccc1
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.12g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.196g/mol
Monoisotopic Mass:
286.12g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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