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Home Boronic acids 4-Chloro-2-((tetrahydro-2H-pyran-2-yl)methoxy)phenylboronic acid

4-Chloro-2-((tetrahydro-2H-pyran-2-yl)methoxy)phenylboronic acid

CAS No.:
2096332-15-7
Catalog Number:
AG01EHKK
Molecular Formula:
C12H16BClO4
Molecular Weight:
270.5170
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$200
- +
5g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG01EHKK
Chemical Name:
4-Chloro-2-((tetrahydro-2H-pyran-2-yl)methoxy)phenylboronic acid
CAS Number:
2096332-15-7
Molecular Formula:
C12H16BClO4
Molecular Weight:
270.5170
MDL Number:
MFCD18311839
IUPAC Name:
[4-chloro-2-(oxan-2-ylmethoxy)phenyl]boronic acid
InChI:
InChI=1S/C12H16BClO4/c14-9-4-5-11(13(15)16)12(7-9)18-8-10-3-1-2-6-17-10/h4-5,7,10,15-16H,1-3,6,8H2
InChI Key:
QENSDXMOEIJQER-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)OCC1CCCCO1)B(O)O
Properties
Complexity:
254  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.083g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
270.516g/mol
Monoisotopic Mass:
270.083g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties