4-Fluoro-1H-indazole-5-carbonitrile - CAS 473416-81-8
Catalog: |
BB026263 |
Product Name: |
4-Fluoro-1H-indazole-5-carbonitrile |
CAS: |
473416-81-8 |
Synonyms: |
4-fluoro-1H-indazole-5-carbonitrile; 4-fluoro-1H-indazole-5-carbonitrile |
IUPAC Name: | 4-fluoro-1H-indazole-5-carbonitrile |
Description: | 4-Fluoro-1H-indazole-5-carbonitrile (CAS# 473416-81-8) is a useful research chemical. |
Molecular Weight: | 161.14 |
Molecular Formula: | C8H4FN3 |
Canonical SMILES: | C1=CC2=C(C=NN2)C(=C1C#N)F |
InChI: | InChI=1S/C8H4FN3/c9-8-5(3-10)1-2-7-6(8)4-11-12-7/h1-2,4H,(H,11,12) |
InChI Key: | WGOKYACZRGAYOZ-UHFFFAOYSA-N |
Boiling Point: | 367.476 °C at 760 mmHg |
Density: | 1.443 g/cm3 |
LogP: | 1.57368 |
Publication Number | Title | Priority Date |
DE-102008038222-A1 | Indazol-5-carboxylic acid derivatives | 20080818 |
WO-2010020307-A2 | Indazole-5-carboxylic acid hydrazide derivatives | 20080818 |
AU-2007331676-A1 | Dihydropyridine derivatives useful as protein kinase inhibitors | 20061214 |
CA-2672167-A1 | Dihydropyridine derivatives useful as protein kinase inhibitors | 20061214 |
CA-2672167-C | Dihydropyridine derivatives useful as protein kinase inhibitors | 20061214 |
Complexity: | 222 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 161.0389253 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 161.0389253 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 52.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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