3-Fluorosalicylaldehyde - CAS 394-50-3
Catalog: |
BB023989 |
Product Name: |
3-Fluorosalicylaldehyde |
CAS: |
394-50-3 |
Synonyms: |
3-fluoro-2-hydroxybenzaldehyde |
IUPAC Name: | 3-fluoro-2-hydroxybenzaldehyde |
Description: | 3-Fluorosalicylaldehyde (CAS# 394-50-3) is a useful research chemical. |
Molecular Weight: | 140.11 |
Molecular Formula: | C7H5FO2 |
Canonical SMILES: | C1=CC(=C(C(=C1)F)O)C=O |
InChI: | InChI=1S/C7H5FO2/c8-6-3-1-2-5(4-9)7(6)10/h1-4,10H |
InChI Key: | NWDHTEIVMDYWQJ-UHFFFAOYSA-N |
Boiling Point: | 176.2 ℃ at 760 mmHg |
Melting Point: | 68-70 ℃ |
Purity: | 95 % |
Density: | 1.35 g/cm3 |
Appearance: | White to light yellow crystalline powder |
MDL: | MFCD00003319 |
LogP: | 1.34380 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113201233-A | Photochromic organic pigment and preparation method thereof | 20210429 |
CN-112707982-A | Ultrahigh molecular weight polyethylene catalyst, and preparation method and application thereof | 20210108 |
CN-111777618-A | Method for preparing medical intermediate 4H-chromene [2, 3-b ] pyridine-3-nitrile through catalysis | 20200814 |
US-11155547-B1 | Compounds for and methods of treating diseases | 20200618 |
CN-111072610-A | Preparation and application of substituted benzofuran 2-formyl hydrazone LSD1 inhibitor | 20191216 |
PMID | Publication Date | Title | Journal |
22199890 | 20111201 | 2-Fluoro-6-[(E)-(pyridin-2-yl)imino-meth-yl]phenol | Acta crystallographica. Section E, Structure reports online |
21583672 | 20090725 | 3-Fluoro-salicylaldoxime at 6.5 GPa | Acta crystallographica. Section E, Structure reports online |
Complexity: | 127 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 140.02735756 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 140.02735756 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 37.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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