1H-Indole-3-acetonitrile


Chemical Name: 1H-Indole-3-acetonitrile
CAS Number: 771-51-7
Product Number: AG008NVZ(AGN-PC-00DZU1)
Synonyms:
MDL No:
Molecular Formula: C10H8N2
Molecular Weight: 156.1839

Identification/Properties


Computed Properties
Molecular Weight:
156.188g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
156.069g/mol
Monoisotopic Mass:
156.069g/mol
Topological Polar Surface Area:
39.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
203
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302+H312+H332
Precautionary Statements:
P280
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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