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51694-22-5

51694-22-5 | 2-NITROPHENYL SELENOCYANATE

CAS No: 51694-22-5 Catalog No: AG003HSW MDL No:MFCD00043146

Product Description

Catalog Number:
AG003HSW
Chemical Name:
2-NITROPHENYL SELENOCYANATE
CAS Number:
51694-22-5
Molecular Formula:
C7H4N2O2Se
Molecular Weight:
227.0789
MDL Number:
MFCD00043146
IUPAC Name:
(2-nitrophenyl) selenocyanate
InChI:
InChI=1S/C7H4N2O2Se/c8-5-12-7-4-2-1-3-6(7)9(10)11/h1-4H
InChI Key:
LHBLJWULWKQRON-UHFFFAOYSA-N
SMILES:
N#C[Se]c1ccccc1[N+](=O)[O-]
EC Number:
257-350-4

Properties

Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.944g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.092g/mol
Monoisotopic Mass:
227.944g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Literature

Title Journal
Interaction of selenium compounds with zinc finger proteins involved in DNA repair. European journal of biochemistry 20040801
Catalytic oxidation of zinc/sulfur coordination sites in proteins by selenium compounds. Antioxidants & redox signaling 20010801

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