Home Boronic acids (4-(Cyclopentanecarbonyl)phenyl)boronic acid

(4-(Cyclopentanecarbonyl)phenyl)boronic acid

CAS No.:
959861-30-4
Catalog Number:
AG003K71
Molecular Formula:
C12H15BO3
Molecular Weight:
218.0567
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Product Description
Catalog Number:
AG003K71
Chemical Name:
(4-(Cyclopentanecarbonyl)phenyl)boronic acid
CAS Number:
959861-30-4
Molecular Formula:
C12H15BO3
Molecular Weight:
218.0567
IUPAC Name:
[4-(cyclopentanecarbonyl)phenyl]boronic acid
InChI:
InChI=1S/C12H15BO3/c14-12(9-3-1-2-4-9)10-5-7-11(8-6-10)13(15)16/h5-9,15-16H,1-4H2
InChI Key:
QUKZBPAMKWYBBY-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)C(=O)C1CCCC1)O
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.111g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
218.059g/mol
Monoisotopic Mass:
218.111g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties