7-Fluoro-4-nitro-1H-indole - CAS 548458-05-5
Catalog: |
BB028834 |
Product Name: |
7-Fluoro-4-nitro-1H-indole |
CAS: |
548458-05-5 |
Synonyms: |
7-fluoro-4-nitro-1H-indole; 7-fluoro-4-nitro-1H-indole |
IUPAC Name: | 7-fluoro-4-nitro-1H-indole |
Description: | 7-Fluoro-4-nitro-1H-indole (CAS# 548458-05-5) is a useful research chemical. |
Molecular Weight: | 180.14 |
Molecular Formula: | C8H5FN2O2 |
Canonical SMILES: | C1=CC(=C2C(=C1[N+](=O)[O-])C=CN2)F |
InChI: | InChI=1S/C8H5FN2O2/c9-6-1-2-7(11(12)13)5-3-4-10-8(5)6/h1-4,10H |
InChI Key: | DPQBBZICAPJZLA-UHFFFAOYSA-N |
LogP: | 0.00000 |
Publication Number | Title | Priority Date |
EP-1458712-A2 | Novel compounds | 20011219 |
JP-2005511760-A | New compounds | 20011219 |
US-2005075334-A1 | Novel compounds | 20011219 |
WO-03051277-A2 | Novel compounds | 20011219 |
JP-2001342242-A | Method for producing polyindole derivative and polyindole derivative obtained thereby | 20000331 |
Complexity: | 219 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 180.03350557 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 180.03350557 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 61.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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