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68844-25-7

68844-25-7 | Benzyltriethylammonium permanganate

CAS No: 68844-25-7 Catalog No: AG006GHP MDL No:

Product Description

Catalog Number:
AG006GHP
Chemical Name:
Benzyltriethylammonium permanganate
CAS Number:
68844-25-7
Molecular Formula:
C13H22MnNO4
Molecular Weight:
311.2561
IUPAC Name:
benzyl(triethyl)azanium;permanganate
InChI:
InChI=1S/C13H22N.Mn.4O/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13;;;;;/h7-11H,4-6,12H2,1-3H3;;;;;/q+1;;;;;-1
InChI Key:
QPIWFXFPNQAMAR-UHFFFAOYSA-N
SMILES:
[O-][Mn](=O)(=O)=O.CC[N+](Cc1ccccc1)(CC)CC
EC Number:
272-440-3

Properties

Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.093g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
311.26g/mol
Monoisotopic Mass:
311.093g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
74.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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