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Home > Boronic Acids > 486422-58-6
486422-58-6 | 4-(1-PIPERIDINYLSULFONYL)PHENYLBORONIC ACID
CAS No: 486422-58-6 Catalog No: AG00D9R7 MDL No:MFCD06659850
Product Description
Catalog Number:
AG00D9R7
Chemical Name:
4-(1-PIPERIDINYLSULFONYL)PHENYLBORONIC ACID
CAS Number:
486422-58-6
Molecular Formula:
C11H16BNO4S
Molecular Weight:
269.1250
MDL Number:
MFCD06659850
IUPAC Name:
(4-piperidin-1-ylsulfonylphenyl)boronic acid
InChI:
InChI=1S/C11H16BNO4S/c14-12(15)10-4-6-11(7-5-10)18(16,17)13-8-2-1-3-9-13/h4-7,14-15H,1-3,8-9H2
InChI Key:
MIEADZYHESCCES-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)S(=O)(=O)N1CCCCC1)O
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.089g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
269.122g/mol
Monoisotopic Mass:
269.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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