5-Cyano-2-furancarboxylic Acid - CAS 212197-74-5
Catalog: |
BB016700 |
Product Name: |
5-Cyano-2-furancarboxylic Acid |
CAS: |
212197-74-5 |
Synonyms: |
5-cyano-2-furancarboxylic acid; 5-cyanofuran-2-carboxylic acid |
IUPAC Name: | 5-cyanofuran-2-carboxylic acid |
Description: | 5-Cyano-2-furancarboxylic Acid (CAS# 212197-74-5) is a useful research chemical. |
Molecular Weight: | 137.09 |
Molecular Formula: | C6H3NO3 |
Canonical SMILES: | C1=C(OC(=C1)C(=O)O)C#N |
InChI: | InChI=1S/C6H3NO3/c7-3-4-1-2-5(10-4)6(8)9/h1-2H,(H,8,9) |
InChI Key: | HHHCADSYQQJUGV-UHFFFAOYSA-N |
Appearance: | Solid |
LogP: | 0.84948 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P312, P305+P351+P338, P330, P337+P313, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021032687-A1 | Antimalarial hexahydropyrimidine analogues | 20190819 |
WO-2020006075-A1 | Positron emission tomography (pet) radiotracers for imaging macrophage colony-stimulating factor 1 receptor (csf1r) in neuroinflammation | 20180626 |
AU-2019294699-A1 | Positron emission tomography (PET) radiotracers for imaging macrophage colony-stimulating factor 1 receptor (CSF1R) in neuroinflammation | 20180626 |
BR-112020026602-A2 | TOMOGRAPHY RADIOTRACER BY POSITIONS EMISSION (PET) FOR THE IMAGIOLOGY OF RECEPTOR OF MACROPHAGIC COLONY STIMULATING FACTOR 1 (CSF1R) IN NEUROINFLAMATION | 20180626 |
CA-3104520-A1 | Positron emission tomography (pet) radiotracers for imaging macrophage colony-stimulating factor 1 receptor (csf1r) in neuroinflammation | 20180626 |
Complexity: | 192 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 137.011292958 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 137.011292958 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 74.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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