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Home Sulfos 3-[(Phenylsulfonyl)amino]propanoic acid

3-[(Phenylsulfonyl)amino]propanoic acid

CAS No.:
31867-78-4
Catalog Number:
AG00CJAM
Molecular Formula:
C9H11NO4S
Molecular Weight:
229.2529
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$119
- +
5g
95%
In Stock USA
United States
$382
- +
10g
95%
In Stock USA
United States
$675
- +
25g
95%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG00CJAM
Chemical Name:
3-[(Phenylsulfonyl)amino]propanoic acid
CAS Number:
31867-78-4
Molecular Formula:
C9H11NO4S
Molecular Weight:
229.2529
MDL Number:
MFCD00601237
IUPAC Name:
3-(benzenesulfonamido)propanoic acid
InChI:
InChI=1S/C9H11NO4S/c11-9(12)6-7-10-15(13,14)8-4-2-1-3-5-8/h1-5,10H,6-7H2,(H,11,12)
InChI Key:
IRSJDWBJMSUIBW-UHFFFAOYSA-N
SMILES:
OC(=O)CCNS(=O)(=O)c1ccccc1
Properties
Complexity:
301  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.041g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
229.25g/mol
Monoisotopic Mass:
229.041g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
91.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
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