Home Sulfos 2-(3-bromobenzenesulfonamido)acetic acid

2-(3-bromobenzenesulfonamido)acetic acid

CAS No.:
731003-85-3
Catalog Number:
AG019INH
Molecular Formula:
C8H8BrNO4S
Molecular Weight:
294.1224
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Product Description
Catalog Number:
AG019INH
Chemical Name:
2-(3-bromobenzenesulfonamido)acetic acid
CAS Number:
731003-85-3
Molecular Formula:
C8H8BrNO4S
Molecular Weight:
294.1224
MDL Number:
MFCD11986947
IUPAC Name:
2-[(3-bromophenyl)sulfonylamino]acetic acid
InChI:
InChI=1S/C8H8BrNO4S/c9-6-2-1-3-7(4-6)15(13,14)10-5-8(11)12/h1-4,10H,5H2,(H,11,12)
InChI Key:
KOUIFODJIUCFDM-UHFFFAOYSA-N
SMILES:
OC(=O)CNS(=O)(=O)c1cccc(c1)Br
Properties
Complexity:
324  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.936g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
294.119g/mol
Monoisotopic Mass:
292.936g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties