Home Sulfos methyl 3-(4-methylbenzenesulfonamido)propanoate

methyl 3-(4-methylbenzenesulfonamido)propanoate

CAS No.:
62456-75-1
Catalog Number:
AG01BCMM
Molecular Formula:
C11H15NO4S
Molecular Weight:
257.3061
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Product Description
Catalog Number:
AG01BCMM
Chemical Name:
methyl 3-(4-methylbenzenesulfonamido)propanoate
CAS Number:
62456-75-1
Molecular Formula:
C11H15NO4S
Molecular Weight:
257.3061
MDL Number:
MFCD00436412
IUPAC Name:
methyl 3-[(4-methylphenyl)sulfonylamino]propanoate
InChI:
InChI=1S/C11H15NO4S/c1-9-3-5-10(6-4-9)17(14,15)12-8-7-11(13)16-2/h3-6,12H,7-8H2,1-2H3
InChI Key:
GUQCJKGSHIOXFA-UHFFFAOYSA-N
SMILES:
COC(=O)CCNS(=O)(=O)c1ccc(cc1)C
NSC Number:
105606
Properties
Complexity:
339  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.072g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
257.304g/mol
Monoisotopic Mass:
257.072g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
80.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties