Home Sulfos 2-(4-bromo-2-chlorobenzenesulfonamido)acetic acid

2-(4-bromo-2-chlorobenzenesulfonamido)acetic acid

CAS No.:
731003-88-6
Catalog Number:
AG019INK
Molecular Formula:
C8H7BrClNO4S
Molecular Weight:
328.5675
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Product Description
Catalog Number:
AG019INK
Chemical Name:
2-(4-bromo-2-chlorobenzenesulfonamido)acetic acid
CAS Number:
731003-88-6
Molecular Formula:
C8H7BrClNO4S
Molecular Weight:
328.5675
MDL Number:
MFCD04625527
IUPAC Name:
2-[(4-bromo-2-chlorophenyl)sulfonylamino]acetic acid
InChI:
InChI=1S/C8H7BrClNO4S/c9-5-1-2-7(6(10)3-5)16(14,15)11-4-8(12)13/h1-3,11H,4H2,(H,12,13)
InChI Key:
KLOLJDKVVISHRN-UHFFFAOYSA-N
SMILES:
OC(=O)CNS(=O)(=O)c1ccc(cc1Cl)Br
Properties
Complexity:
356  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.897g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
328.561g/mol
Monoisotopic Mass:
326.897g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties