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956501-19-2

956501-19-2 | 5-(Benzo[B]Thiazol-2-yl)Thiophene-2-boronic acid

CAS No: 956501-19-2 Catalog No: AG00IJB0 MDL No:MFCD09879850

Product Description

Catalog Number:
AG00IJB0
Chemical Name:
5-(Benzo[B]Thiazol-2-yl)Thiophene-2-boronic acid
CAS Number:
956501-19-2
Molecular Formula:
C11H8BNO2S2
Molecular Weight:
261.1277
MDL Number:
MFCD09879850
IUPAC Name:
[5-(1,3-benzothiazol-2-yl)thiophen-2-yl]boronic acid
InChI:
InChI=1S/C11H8BNO2S2/c14-12(15)10-6-5-9(16-10)11-13-7-3-1-2-4-8(7)17-11/h1-6,14-15H
InChI Key:
CXDWUVFXUHCNPL-UHFFFAOYSA-N
SMILES:
OB(c1ccc(s1)c1nc2c(s1)cccc2)O

Properties

Complexity:
282  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.009g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
261.12g/mol
Monoisotopic Mass:
261.009g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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