1-[(4-methoxyphenyl)methyl]-5-(trifluoromethoxy)indole-2,3-dione


Chemical Name: 1-[(4-methoxyphenyl)methyl]-5-(trifluoromethoxy)indole-2,3-dione
CAS Number: 1160247-92-6
Product Number: AG000BF3(AGN-PC-069AB1)
Synonyms:
MDL No:
Molecular Formula: C17H12F3NO4
Molecular Weight: 351.2767

Identification/Properties


Computed Properties
Molecular Weight:
351.281g/mol
XLogP3:
3.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
4
Exact Mass:
351.072g/mol
Monoisotopic Mass:
351.072g/mol
Topological Polar Surface Area:
55.8A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
517
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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