1-isobutyl-1H-indole-2,3-dione


Chemical Name: 1-isobutyl-1H-indole-2,3-dione
CAS Number: 78846-77-2
Product Number: AG00G3UX(AGN-PC-0WAL6I)
Synonyms:
MDL No:
Molecular Formula: C12H13NO2
Molecular Weight: 203.2371

Identification/Properties


Computed Properties
Molecular Weight:
203.241g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
203.095g/mol
Monoisotopic Mass:
203.095g/mol
Topological Polar Surface Area:
37.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
285
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

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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