1H-Indole-3-carboxaldehyde, 6-nitro-


Chemical Name: 1H-Indole-3-carboxaldehyde, 6-nitro-
CAS Number: 10553-13-6
Product Number: AG0095XN(AGN-PC-0LOIK9)
Synonyms:
MDL No:
Molecular Formula: C9H6N2O3
Molecular Weight: 190.1555

Identification/Properties


Computed Properties
Molecular Weight:
190.158g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
190.038g/mol
Monoisotopic Mass:
190.038g/mol
Topological Polar Surface Area:
78.7A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
251
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#:
N/A
Hazard Statements:
H302-H317
Precautionary Statements:
P280
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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