Home Sulfos 2-amino-2-(4-methanesulfonylphenyl)propanoic acid

2-amino-2-(4-methanesulfonylphenyl)propanoic acid

CAS No.:
1134693-74-5
Catalog Number:
AG01BH7U
Molecular Formula:
C10H13NO4S
Molecular Weight:
243.2795
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Product Description
Catalog Number:
AG01BH7U
Chemical Name:
2-amino-2-(4-methanesulfonylphenyl)propanoic acid
CAS Number:
1134693-74-5
Molecular Formula:
C10H13NO4S
Molecular Weight:
243.2795
MDL Number:
MFCD09942228
IUPAC Name:
2-amino-2-(4-methylsulfonylphenyl)propanoic acid
InChI:
InChI=1S/C10H13NO4S/c1-10(11,9(12)13)7-3-5-8(6-4-7)16(2,14)15/h3-6H,11H2,1-2H3,(H,12,13)
InChI Key:
OXYKPEXSYCFJGQ-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccc(cc1)S(=O)(=O)C)(N)C
Properties
Complexity:
365  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.057g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
243.277g/mol
Monoisotopic Mass:
243.057g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-2.3  
Properties