Home Sulfos 2-[4-(N-methyl4-ethoxybenzenesulfonamido)phenoxy]acetic acid

2-[4-(N-methyl4-ethoxybenzenesulfonamido)phenoxy]acetic acid

CAS No.:
380342-64-3
Catalog Number:
AG019GMU
Molecular Formula:
C17H19NO6S
Molecular Weight:
365.4009
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Product Description
Catalog Number:
AG019GMU
Chemical Name:
2-[4-(N-methyl4-ethoxybenzenesulfonamido)phenoxy]acetic acid
CAS Number:
380342-64-3
Molecular Formula:
C17H19NO6S
Molecular Weight:
365.4009
MDL Number:
MFCD02724576
IUPAC Name:
2-[4-[(4-ethoxyphenyl)sulfonyl-methylamino]phenoxy]acetic acid
InChI:
InChI=1S/C17H19NO6S/c1-3-23-14-8-10-16(11-9-14)25(21,22)18(2)13-4-6-15(7-5-13)24-12-17(19)20/h4-11H,3,12H2,1-2H3,(H,19,20)
InChI Key:
SADVAMHHRRGUNT-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)S(=O)(=O)N(c1ccc(cc1)OCC(=O)O)C
Properties
Complexity:
516  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
365.093g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
365.4g/mol
Monoisotopic Mass:
365.093g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties