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Home > Boronic Acids > 710348-58-6
710348-58-6 | {4-[2-(piperidin-1-yl)ethoxy]phenyl}boronic acid
CAS No: 710348-58-6 Catalog No: AG01ABDJ MDL No:MFCD09743123
Product Description
Catalog Number:
AG01ABDJ
Chemical Name:
{4-[2-(piperidin-1-yl)ethoxy]phenyl}boronic acid
CAS Number:
710348-58-6
Molecular Formula:
C13H20BNO3
Molecular Weight:
249.1138
MDL Number:
MFCD09743123
IUPAC Name:
[4-(2-piperidin-1-ylethoxy)phenyl]boronic acid
InChI:
InChI=1S/C13H20BNO3/c16-14(17)12-4-6-13(7-5-12)18-11-10-15-8-2-1-3-9-15/h4-7,16-17H,1-3,8-11H2
InChI Key:
BSKNUDYIGGHKRG-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)OCCN1CCCCC1)O
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.154g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.117g/mol
Monoisotopic Mass:
249.154g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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