Home Sulfos 3-(3-bromobenzenesulfonamido)propanoic acid

3-(3-bromobenzenesulfonamido)propanoic acid

CAS No.:
785792-43-0
Catalog Number:
AG019JXV
Molecular Formula:
C9H10BrNO4S
Molecular Weight:
308.1490
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Product Description
Catalog Number:
AG019JXV
Chemical Name:
3-(3-bromobenzenesulfonamido)propanoic acid
CAS Number:
785792-43-0
Molecular Formula:
C9H10BrNO4S
Molecular Weight:
308.1490
MDL Number:
MFCD06351000
IUPAC Name:
3-[(3-bromophenyl)sulfonylamino]propanoic acid
InChI:
InChI=1S/C9H10BrNO4S/c10-7-2-1-3-8(6-7)16(14,15)11-5-4-9(12)13/h1-3,6,11H,4-5H2,(H,12,13)
InChI Key:
JBXKHAAFCMCAFR-UHFFFAOYSA-N
SMILES:
OC(=O)CCNS(=O)(=O)c1cccc(c1)Br
Properties
Complexity:
338  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.951g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
308.146g/mol
Monoisotopic Mass:
306.951g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties