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Home > Boronic Acids > 362612-68-8
362612-68-8 | 4-PHENYLTHIOPHENE-2-BORONIC ACID
CAS No: 362612-68-8 Catalog No: AG00C6N6 MDL No:MFCD12032480
Product Description
Catalog Number:
AG00C6N6
Chemical Name:
4-PHENYLTHIOPHENE-2-BORONIC ACID
CAS Number:
362612-68-8
Molecular Formula:
C16H19BO2S
Molecular Weight:
286.1969
MDL Number:
MFCD12032480
IUPAC Name:
(4-phenylthiophen-2-yl)boronic acid
InChI:
InChI=1S/C10H9BO2S/c12-11(13)10-6-9(7-14-10)8-4-2-1-3-5-8/h1-7,12-13H
InChI Key:
SSHJHAPMTBLTLN-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1scc(c1)c1ccccc1
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.042g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
204.05g/mol
Monoisotopic Mass:
204.042g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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