3,5-Difluorobenzamide - CAS 132980-99-5
Catalog: |
BB007665 |
Product Name: |
3,5-Difluorobenzamide |
CAS: |
132980-99-5 |
Synonyms: |
3,5-difluorobenzamide |
IUPAC Name: | 3,5-difluorobenzamide |
Description: | 3,5-Difluorobenzamide (CAS# 132980-99-5) is a useful research chemical. |
Molecular Weight: | 157.12 |
Molecular Formula: | C7H5F2NO |
Canonical SMILES: | C1=C(C=C(C=C1F)F)C(=O)N |
InChI: | InChI=1S/C7H5F2NO/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H,(H2,10,11) |
InChI Key: | CGOIBYYWOVRGGV-UHFFFAOYSA-N |
Boiling Point: | 187.7 ℃ at 760 mmHg |
Melting Point: | 155-157 ℃ |
Purity: | 95 % |
Density: | 1.348 g/cm3 |
Appearance: | Solid |
Storage: | Keep in dark place, Sealed in dry, Room Temperature |
MDL: | MFCD00061138 |
LogP: | 1.76400 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021001328-A1 | Process for manufacturing (s)-3-hydroxy-1-(1h-indol-5-yl)-2-oxo-pyrrolidine-3-carboxylic acid 3,5-difluoro-benzylamide | 20190703 |
WO-2020264499-A1 | Irak degraders and uses thereof | 20190628 |
WO-2020168017-A1 | Compositions containing, methods and uses of antibody-tlr agonist conjugates | 20190212 |
WO-2019195634-A1 | Opioid receptor modulators and products and methods related thereto | 20180404 |
EP-3774722-A1 | Opioid receptor modulators and products and methods related thereto | 20180404 |
PMID | Publication Date | Title | Journal |
12182629 | 20020823 | Anion binding by fluorescent biimidazole diamides | The Journal of organic chemistry |
Complexity: | 153 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 157.03392011 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 157.03392011 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 43.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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