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Home > Boronic Acids > 913835-28-6
913835-28-6 | (3-(N-Cyclopropylsulfamoyl)phenyl)boronic acid
CAS No: 913835-28-6 Catalog No: AG0036S9 MDL No:MFCD08436035
Product Description
Catalog Number:
AG0036S9
Chemical Name:
(3-(N-Cyclopropylsulfamoyl)phenyl)boronic acid
CAS Number:
913835-28-6
Molecular Formula:
C9H12BNO4S
Molecular Weight:
241.0719
MDL Number:
MFCD08436035
IUPAC Name:
[3-(cyclopropylsulfamoyl)phenyl]boronic acid
InChI:
InChI=1S/C9H12BNO4S/c12-10(13)7-2-1-3-9(6-7)16(14,15)11-8-4-5-8/h1-3,6,8,11-13H,4-5H2
InChI Key:
WIZSPBQIRRAOMO-UHFFFAOYSA-N
SMILES:
OB(c1cccc(c1)S(=O)(=O)NC1CC1)O
Properties
Complexity:
336
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.058g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
241.068g/mol
Monoisotopic Mass:
241.058g/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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