Home Boronic acids (4-(N,N-diMethylsulfaMoyl)-3,5-diMethylphenyl)boronic acid

(4-(N,N-diMethylsulfaMoyl)-3,5-diMethylphenyl)boronic acid

CAS No.:
1704067-27-5
Catalog Number:
AG00ARDD
Molecular Formula:
C10H16BNO4S
Molecular Weight:
257.1143
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Product Description
Catalog Number:
AG00ARDD
Chemical Name:
(4-(N,N-diMethylsulfaMoyl)-3,5-diMethylphenyl)boronic acid
CAS Number:
1704067-27-5
Molecular Formula:
C10H16BNO4S
Molecular Weight:
257.1143
MDL Number:
MFCD28384285
IUPAC Name:
[4-(dimethylsulfamoyl)-3,5-dimethylphenyl]boronic acid
InChI:
InChI=1S/C10H16BNO4S/c1-7-5-9(11(13)14)6-8(2)10(7)17(15,16)12(3)4/h5-6,13-14H,1-4H3
InChI Key:
LXLPZSFYAKFYEA-UHFFFAOYSA-N
SMILES:
OB(c1cc(C)c(c(c1)C)S(=O)(=O)N(C)C)O
Properties
Complexity:
340  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.089g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
257.111g/mol
Monoisotopic Mass:
257.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
86.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties