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Home Boronic acids 3-Chloromethylphenylboronic acid pinacol ester

3-Chloromethylphenylboronic acid pinacol ester

CAS No.:
1073353-44-2
Catalog Number:
AG007ENP
Molecular Formula:
C13H18BClO2
Molecular Weight:
252.5448
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$82
- +
5g
98%
In Stock USA
United States
$244
- +
10g
98%
In Stock USA
United States
$407
- +
Product Description
Catalog Number:
AG007ENP
Chemical Name:
3-Chloromethylphenylboronic acid pinacol ester
CAS Number:
1073353-44-2
Molecular Formula:
C13H18BClO2
Molecular Weight:
252.5448
MDL Number:
MFCD11053847
IUPAC Name:
2-[3-(chloromethyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C13H18BClO2/c1-12(2)13(3,4)17-14(16-12)11-7-5-6-10(8-11)9-15/h5-8H,9H2,1-4H3
InChI Key:
KWUGBVHPELQIAF-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
265  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.109g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.545g/mol
Monoisotopic Mass:
252.109g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties