Home Boronic acids 4-Benzylthiophenylboronic acid

4-Benzylthiophenylboronic acid

CAS No.:
1005207-32-8
Catalog Number:
AG00028U
Molecular Formula:
C13H13BO2S
Molecular Weight:
244.1171
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$75
- +
5g
96%
In Stock USA
United States
$225
- +
25g
96%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG00028U
Chemical Name:
4-Benzylthiophenylboronic acid
CAS Number:
1005207-32-8
Molecular Formula:
C13H13BO2S
Molecular Weight:
244.1171
MDL Number:
MFCD06801692
IUPAC Name:
(4-benzylsulfanylphenyl)boronic acid
InChI:
InChI=1S/C13H13BO2S/c15-14(16)12-6-8-13(9-7-12)17-10-11-4-2-1-3-5-11/h1-9,15-16H,10H2
InChI Key:
ALXFJPATEOZQPF-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)SCc1ccccc1)O
Properties
Complexity:
212  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.073g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
244.115g/mol
Monoisotopic Mass:
244.073g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties