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Home > Boronic Acids > 871329-65-6
871329-65-6 | (4-(N-Ethylsulfamoyl)phenyl)boronic acid
CAS No: 871329-65-6 Catalog No: AG008FBL MDL No:MFCD07363751
Product Description
Catalog Number:
AG008FBL
Chemical Name:
(4-(N-Ethylsulfamoyl)phenyl)boronic acid
CAS Number:
871329-65-6
Molecular Formula:
C8H12BNO4S
Molecular Weight:
229.0612
MDL Number:
MFCD07363751
IUPAC Name:
[4-(ethylsulfamoyl)phenyl]boronic acid
InChI:
InChI=1S/C8H12BNO4S/c1-2-10-15(13,14)8-5-3-7(4-6-8)9(11)12/h3-6,10-12H,2H2,1H3
InChI Key:
YVKVLCDUDPTJEW-UHFFFAOYSA-N
SMILES:
CCNS(=O)(=O)c1ccc(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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