1H-Indole-3-carboxylic acid, 5-chloro-


Chemical Name: 1H-Indole-3-carboxylic acid, 5-chloro-
CAS Number: 10406-05-0
Product Number: AG007F28(AGN-PC-01MGT4)
Synonyms:
MDL No:
Molecular Formula: C9H6ClNO2
Molecular Weight: 195.6024

Identification/Properties


Computed Properties
Molecular Weight:
195.602g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
195.009g/mol
Monoisotopic Mass:
195.009g/mol
Topological Polar Surface Area:
53.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
222
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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