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Home > Boronic Acids > 1311182-51-0
1311182-51-0 | [4-(2-PIPERIDIN-1-YLETHYL)PHENYL]BORONIC ACID
CAS No: 1311182-51-0 Catalog No: AG01AQMW MDL No:MFCD16653224
Product Description
Catalog Number:
AG01AQMW
Chemical Name:
[4-(2-PIPERIDIN-1-YLETHYL)PHENYL]BORONIC ACID
CAS Number:
1311182-51-0
Molecular Formula:
C13H20BNO2
Molecular Weight:
233.1144
MDL Number:
MFCD16653224
IUPAC Name:
[4-(2-piperidin-1-ylethyl)phenyl]boronic acid
InChI:
InChI=1S/C13H20BNO2/c16-14(17)13-6-4-12(5-7-13)8-11-15-9-2-1-3-10-15/h4-7,16-17H,1-3,8-11H2
InChI Key:
NTYIKWNTASYFPS-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)CCN1CCCCC1)O
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.159g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
233.118g/mol
Monoisotopic Mass:
233.159g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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