Home Sulfos 2-(4-Bromo-benzenesulfonylamino)-3-hydroxy-propionic acid

2-(4-Bromo-benzenesulfonylamino)-3-hydroxy-propionic acid

CAS No.:
1008243-95-5
Catalog Number:
AG00H9CD
Molecular Formula:
C9H10BrNO5S
Molecular Weight:
324.1484
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Product Description
Catalog Number:
AG00H9CD
Chemical Name:
2-(4-Bromo-benzenesulfonylamino)-3-hydroxy-propionic acid
CAS Number:
1008243-95-5
Molecular Formula:
C9H10BrNO5S
Molecular Weight:
324.1484
MDL Number:
MFCD02932429
IUPAC Name:
2-[(4-bromophenyl)sulfonylamino]-3-hydroxypropanoic acid
InChI:
InChI=1S/C9H10BrNO5S/c10-6-1-3-7(4-2-6)17(15,16)11-8(5-12)9(13)14/h1-4,8,11-12H,5H2,(H,13,14)
InChI Key:
ZNIKCDQUKAIUGM-UHFFFAOYSA-N
SMILES:
OCC(C(=O)O)NS(=O)(=O)c1ccc(cc1)Br
Properties
Complexity:
358  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.946g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
324.145g/mol
Monoisotopic Mass:
322.946g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties