5-Chloro-6-fluoroisatin - CAS 953897-06-8
Catalog: |
BB041702 |
Product Name: |
5-Chloro-6-fluoroisatin |
CAS: |
953897-06-8 |
Synonyms: |
5-chloro-6-fluoro-1H-indole-2,3-dione; 5-chloro-6-fluoro-1H-indole-2,3-dione |
IUPAC Name: | 5-chloro-6-fluoro-1H-indole-2,3-dione |
Description: | 5-Chloro-6-fluoroisatin (CAS# 953897-06-8) is a useful research chemical. |
Molecular Weight: | 199.57 |
Molecular Formula: | C8H3ClFNO2 |
Canonical SMILES: | C1=C2C(=CC(=C1Cl)F)NC(=O)C2=O |
InChI: | InChI=1S/C8H3ClFNO2/c9-4-1-3-6(2-5(4)10)11-8(13)7(3)12/h1-2H,(H,11,12,13) |
InChI Key: | GLZQDDOVGRLCHY-UHFFFAOYSA-N |
MDL: | MFCD09728573 |
LogP: | -0.25930 |
Publication Number | Title | Priority Date |
WO-2016202935-A1 | Glucose transport inhibitors | 20150619 |
CA-2955872-A1 | Glucose transport inhibitors | 20140724 |
CA-2955882-A1 | Glucose transport inhibitors | 20140724 |
EP-3172192-A1 | Glucose transport inhibitors | 20140724 |
EP-3172194-A1 | Glucose transport inhibitors | 20140724 |
Complexity: | 271 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.9836342 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.9836342 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 46.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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