Home Boronic acids (6-Methylbenzo[b]thiophen-2-yl)boronic acid

(6-Methylbenzo[b]thiophen-2-yl)boronic acid

CAS No.:
820240-91-3
Catalog Number:
AG005D7F
Molecular Formula:
C9H9BO2S
Molecular Weight:
192.0426
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Product Description
Catalog Number:
AG005D7F
Chemical Name:
(6-Methylbenzo[b]thiophen-2-yl)boronic acid
CAS Number:
820240-91-3
Molecular Formula:
C9H9BO2S
Molecular Weight:
192.0426
MDL Number:
MFCD09952059
IUPAC Name:
(6-methyl-1-benzothiophen-2-yl)boronic acid
InChI:
InChI=1S/C9H9BO2S/c1-6-2-3-7-5-9(10(11)12)13-8(7)4-6/h2-5,11-12H,1H3
InChI Key:
PRLYUBNPLSDOSJ-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)sc(c2)B(O)O
Properties
Complexity:
189  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.042g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
192.039g/mol
Monoisotopic Mass:
192.042g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
68.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties