Benz[cd]indol-2(1H)-one


Chemical Name: Benz[cd]indol-2(1H)-one
CAS Number: 130-00-7
Product Number: AG000TUX(AGN-PC-0JL7OF)
Synonyms:
MDL No:
Molecular Formula: C11H7NO
Molecular Weight: 169.1794

Identification/Properties


Properties
MP:
173-178 °C
BP:
234.7 °C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.4900 (estimate)
Solubility:
methanol: soluble25mg/mL, clear to slightly hazy, yellow to brown
Computed Properties
Molecular Weight:
169.183g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
169.053g/mol
Monoisotopic Mass:
169.053g/mol
Topological Polar Surface Area:
29.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
238
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
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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