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Home Boronic acids 3-Fluoro-4-(methylthio)phenylboronic acid pinacol ester

3-Fluoro-4-(methylthio)phenylboronic acid pinacol ester

CAS No.:
1351499-74-5
Catalog Number:
AG00HTWR
Molecular Formula:
C13H18BFO2S
Molecular Weight:
268.1552
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$210
- +
5g
98%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG00HTWR
Chemical Name:
3-Fluoro-4-(methylthio)phenylboronic acid pinacol ester
CAS Number:
1351499-74-5
Molecular Formula:
C13H18BFO2S
Molecular Weight:
268.1552
MDL Number:
MFCD22494876
IUPAC Name:
2-(3-fluoro-4-methylsulfanylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H18BFO2S/c1-12(2)13(3,4)17-14(16-12)9-6-7-11(18-5)10(15)8-9/h6-8H,1-5H3
InChI Key:
YPODIIJXGHJKSH-UHFFFAOYSA-N
SMILES:
CSc1ccc(cc1F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.11g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.153g/mol
Monoisotopic Mass:
268.11g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties