6-Nitroindole-3-carboxylic Acid - CAS 10242-03-2
Catalog: |
BB000854 |
Product Name: |
6-Nitroindole-3-carboxylic Acid |
CAS: |
10242-03-2 |
Synonyms: |
6-nitro-1H-indole-3-carboxylic acid; 6-nitro-1H-indole-3-carboxylic acid |
IUPAC Name: | 6-nitro-1H-indole-3-carboxylic acid |
Description: | 6-Nitroindole-3-carboxylic Acid (CAS# 10242-03-2) is a useful research chemical. |
Molecular Weight: | 206.15 |
Molecular Formula: | C9H6N2O4 |
Canonical SMILES: | C1=CC2=C(C=C1[N+](=O)[O-])NC=C2C(=O)O |
InChI: | InChI=1S/C9H6N2O4/c12-9(13)7-4-10-8-3-5(11(14)15)1-2-6(7)8/h1-4,10H,(H,12,13) |
InChI Key: | MWFVAHOPRCFNCA-UHFFFAOYSA-N |
Boiling Point: | 520.8 °C at 760 mmHg |
Density: | 1.632 g/cm3 |
Storage: | Keep in dark place, Inert atmosphere, 2-8 °C |
MDL: | MFCD07779489 |
LogP: | 2.29750 |
Publication Number | Title | Priority Date |
WO-2020252240-A1 | Compounds and compositions for treating conditions associated with sting activity | 20190614 |
WO-2017153952-A1 | 5-sulfamoyl-2-hydroxybenzamide derivatives | 20160310 |
CA-2681124-A1 | New substituted arylsulphonylglycines, the preparation thereof and the use thereof as pharmaceutical compositions | 20070316 |
DE-102007012284-A1 | Novel substituted arylsulfonylglycines, their preparation and their use as pharmaceuticals | 20070316 |
EP-2125718-A2 | New substituted arylsulphonylglycines, the preparation thereof and the use thereof as pharmaceutical compositions | 20070316 |
Complexity: | 288 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.03275668 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.03275668 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 98.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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