(2S)-2-(1H-indol-2-yl)propanenitrile


Chemical Name: (2S)-2-(1H-indol-2-yl)propanenitrile
CAS Number: 76017-87-3
Product Number: AG005SEJ(AGN-PC-05W1XT)
Synonyms:
MDL No:
Molecular Formula: C11H10N2
Molecular Weight: 170.2105

Identification/Properties


Properties
MP:
80-83ºC
Storage:
-10 ℃;
Computed Properties
Molecular Weight:
170.215g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
170.084g/mol
Monoisotopic Mass:
170.084g/mol
Topological Polar Surface Area:
39.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
228
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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