1H-Indole-3-carboxaldehyde, 4-chloro-


Chemical Name: 1H-Indole-3-carboxaldehyde, 4-chloro-
CAS Number: 876-72-2
Product Number: AG004O02(AGN-PC-00MT6H)
Synonyms:
MDL No:
Molecular Formula: C9H6ClNO
Molecular Weight: 179.6030

Identification/Properties


Properties
MP:
166 - 167 °C
BP:
373.4 °C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
179.603g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
179.014g/mol
Monoisotopic Mass:
179.014g/mol
Topological Polar Surface Area:
32.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
185
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


NMR Spectrum


Other Analytical Data


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