1H-Indole-2-carboxylic acid, 5,6,7-trimethoxy-


Chemical Name: 1H-Indole-2-carboxylic acid, 5,6,7-trimethoxy-
CAS Number: 128781-07-7
Product Number: AG000YDN(AGN-PC-0JWK2B)
Synonyms:
MDL No:
Molecular Formula: C12H13NO5
Molecular Weight: 251.2353

Identification/Properties


Computed Properties
Molecular Weight:
251.238g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
251.079g/mol
Monoisotopic Mass:
251.079g/mol
Topological Polar Surface Area:
80.8A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
311
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-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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