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645-96-5

645-96-5 | PHENYLSELENOL

CAS No: 645-96-5 Catalog No: AG003TQ5 MDL No:MFCD00000001

Product Description

Catalog Number:
AG003TQ5
Chemical Name:
PHENYLSELENOL
CAS Number:
645-96-5
Molecular Formula:
C6H6Se
Molecular Weight:
157.0718
MDL Number:
MFCD00000001
InChI:
InChI=1S/C6H5Se/c7-6-4-2-1-3-5-6/h1-5H
InChI Key:
YWBHROUQJYHSOR-UHFFFAOYSA-N
SMILES:
[SeH]c1ccccc1
EC Number:
211-457-2

Properties

Complexity:
46.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.956g/mol
Formal Charge:
0
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
156.077g/mol
Monoisotopic Mass:
156.956g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

Literature

Title Journal
Fast and selective modification of thiol proteins/peptides by N-(phenylseleno)phthalimide. Journal of the American Society for Mass Spectrometry 20120301
DFT study of the glutathione peroxidase-like activity of phenylselenol incorporating solvent-assisted proton exchange. The journal of physical chemistry. A 20070920

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