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Home > Boronic Acids > 1217501-02-4
1217501-02-4 | Boronic acid, B-[4-(butylsulfonyl)phenyl]-
CAS No: 1217501-02-4 Catalog No: AG0015RM MDL No:MFCD12546549
Product Description
Catalog Number:
AG0015RM
Chemical Name:
Boronic acid, B-[4-(butylsulfonyl)phenyl]-
CAS Number:
1217501-02-4
Molecular Formula:
C10H15BO4S
Molecular Weight:
242.0997
MDL Number:
MFCD12546549
IUPAC Name:
(4-butylsulfonylphenyl)boronic acid
InChI:
InChI=1S/C10H15BO4S/c1-2-3-8-16(14,15)10-6-4-9(5-7-10)11(12)13/h4-7,12-13H,2-3,8H2,1H3
InChI Key:
YGBYIKCBEZABIT-UHFFFAOYSA-N
SMILES:
CCCCS(=O)(=O)c1ccc(cc1)B(O)O
Properties
Complexity:
288
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.078g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
242.096g/mol
Monoisotopic Mass:
242.078g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
83A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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