3'-Fluoropropiophenone - CAS 455-67-4
Catalog: |
BB025929 |
Product Name: |
3'-Fluoropropiophenone |
CAS: |
455-67-4 |
Synonyms: |
1-(3-fluorophenyl)-1-propanone; 1-(3-fluorophenyl)propan-1-one |
IUPAC Name: | 1-(3-fluorophenyl)propan-1-one |
Description: | Bupropion intermediate. |
Molecular Weight: | 152.17 |
Molecular Formula: | C9H9FO |
Canonical SMILES: | CCC(=O)C1=CC(=CC=C1)F |
InChI: | InChI=1S/C9H9FO/c1-2-9(11)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3 |
InChI Key: | RPMOHVRRKYJFSB-UHFFFAOYSA-N |
Boiling Point: | 209.8 °C at 760 mmHg |
Density: | 1.074 g/cm3 |
MDL: | MFCD00061245 |
LogP: | 2.41840 |
GHS Hazard Statement: | H302 (11.11%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021085321-A1 | Resin composition, resin sheet, cured film, method for manufacturing cured film, semiconductor device, organic el display device, and display device | 20191029 |
WO-2020148641-A1 | Process for preparation of 2-amino-5-hydroxy propiophenone | 20190115 |
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Complexity: | 145 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 152.063743068 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 152.063743068 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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