1H-Indole-2-carboxylic acid, 5,6-dihydroxy-


Chemical Name: 1H-Indole-2-carboxylic acid, 5,6-dihydroxy-
CAS Number: 4790-08-3
Product Number: AG00DDBG(AGN-PC-0JLMCG)
Synonyms:
MDL No:
Molecular Formula: C9H7NO4
Molecular Weight: 193.1562

Identification/Properties


Computed Properties
Molecular Weight:
193.158g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
193.038g/mol
Monoisotopic Mass:
193.038g/mol
Topological Polar Surface Area:
93.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
245
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

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NMR Spectrum


Other Analytical Data


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