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Home > Boronic Acids > 1704095-87-3
1704095-87-3 | (4-(N-(tert-butyl)sulfaMoyl)-3-fluorophenyl)boronic acid
CAS No: 1704095-87-3 Catalog No: AG00ARDB MDL No:
Product Description
Catalog Number:
AG00ARDB
Chemical Name:
(4-(N-(tert-butyl)sulfaMoyl)-3-fluorophenyl)boronic acid
CAS Number:
1704095-87-3
Molecular Formula:
C10H15BFNO4S
Molecular Weight:
275.1048
IUPAC Name:
[4-(tert-butylsulfamoyl)-3-fluorophenyl]boronic acid
InChI:
InChI=1S/C10H15BFNO4S/c1-10(2,3)13-18(16,17)9-5-4-7(11(14)15)6-8(9)12/h4-6,13-15H,1-3H3
InChI Key:
PIYBHQOGXHFNJL-UHFFFAOYSA-N
SMILES:
Fc1cc(ccc1S(=O)(=O)NC(C)(C)C)B(O)O
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.08g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
275.101g/mol
Monoisotopic Mass:
275.08g/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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