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Home > Nitro Compounds > 15054-44-1

15054-44-1

15054-44-1 | Glycine, N-[(4-nitrophenyl)sulfonyl]-

CAS No: 15054-44-1 Catalog No: AG00HXT0 MDL No:MFCD00441205

Product Description

Catalog Number:
AG00HXT0
Chemical Name:
Glycine, N-[(4-nitrophenyl)sulfonyl]-
CAS Number:
15054-44-1
Molecular Formula:
C8H8N2O6S
Molecular Weight:
260.2239
MDL Number:
MFCD00441205
IUPAC Name:
2-[(4-nitrophenyl)sulfonylamino]acetic acid
InChI:
InChI=1S/C8H8N2O6S/c11-8(12)5-9-17(15,16)7-3-1-6(2-4-7)10(13)14/h1-4,9H,5H2,(H,11,12)
InChI Key:
UKNQJRNNXSNVTM-UHFFFAOYSA-N
SMILES:
OC(=O)CNS(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

Properties

Complexity:
387  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.01g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
260.22g/mol
Monoisotopic Mass:
260.01g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  

Literature

Title Journal
Design and synthesis of N-(3,5-difluoro-4-hydroxyphenyl)benzenesulfonamides as aldose reductase inhibitors. Bioorganic & medicinal chemistry 20080401

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