6-Fluorosalicylaldehyde - CAS 38226-10-7
Catalog: |
BB023587 |
Product Name: |
6-Fluorosalicylaldehyde |
CAS: |
38226-10-7 |
Synonyms: |
2-fluoro-6-hydroxybenzaldehyde; 2-fluoro-6-hydroxybenzaldehyde |
IUPAC Name: | 2-fluoro-6-hydroxybenzaldehyde |
Description: | Used in the preparation of aromatic compounds as human PAI-1 inhibitors. |
Molecular Weight: | 140.11 |
Molecular Formula: | C7H5FO2 |
Canonical SMILES: | C1=CC(=C(C(=C1)F)C=O)O |
InChI: | InChI=1S/C7H5FO2/c8-6-2-1-3-7(10)5(6)4-9/h1-4,10H |
InChI Key: | FZIBGCDUHZBOLA-UHFFFAOYSA-N |
Boiling Point: | 201.3 ℃ at 760 mmHg |
Density: | 1.35 g/cm3 |
MDL: | MFCD01090996 |
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 |
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 |
WO-2021101903-A1 | Dual androgen receptor/akr1c3 inhibitors | 20191118 |
CN-110724140-A | Dihydroquinozinone carboxylic acid compound and application thereof | 20191104 |
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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