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Home > Boronic Acids > 1072945-62-0
1072945-62-0 | (4-(Ethylsulfonamido)phenyl)boronic acid
CAS No: 1072945-62-0 Catalog No: AG007WOS MDL No:MFCD10699608
Product Description
Catalog Number:
AG007WOS
Chemical Name:
(4-(Ethylsulfonamido)phenyl)boronic acid
CAS Number:
1072945-62-0
Molecular Formula:
C8H12BNO4S
Molecular Weight:
229.0612
MDL Number:
MFCD10699608
IUPAC Name:
[4-(ethylsulfonylamino)phenyl]boronic acid
InChI:
InChI=1S/C8H12BNO4S/c1-2-15(13,14)10-8-5-3-7(4-6-8)9(11)12/h3-6,10-12H,2H2,1H3
InChI Key:
DFGZKFSYJUXPOK-UHFFFAOYSA-N
SMILES:
CCS(=O)(=O)Nc1ccc(cc1)B(O)O
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.058g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
229.057g/mol
Monoisotopic Mass:
229.058g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
95A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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