1-(2-Hydroxyphenyl)-3-phenyl-1,3-propanedione - CAS 1469-94-9
Catalog: |
BB010143 |
Product Name: |
1-(2-Hydroxyphenyl)-3-phenyl-1,3-propanedione |
CAS: |
1469-94-9 |
Synonyms: |
1-(2-hydroxyphenyl)-3-phenylpropane-1,3-dione |
IUPAC Name: | 1-(2-hydroxyphenyl)-3-phenylpropane-1,3-dione |
Description: | 1-(2-Hydroxyphenyl)-3-phenyl-1,3-propanedione (CAS# 1469-94-9 ) is a useful research chemical. |
Molecular Weight: | 240.25 |
Molecular Formula: | C15H12O3 |
Canonical SMILES: | C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=CC=C2O |
InChI: | InChI=1S/C15H12O3/c16-13-9-5-4-8-12(13)15(18)10-14(17)11-6-2-1-3-7-11/h1-9,16H,10H2 |
InChI Key: | OABFIJGAEVKMJP-UHFFFAOYSA-N |
Boiling Point: | 421 ℃ at 760 mmHg |
Density: | 1.23 g/cm3 |
MDL: | MFCD00043495 |
LogP: | 2.84790 |
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 |
WO-2019238261-A1 | METAL COMPLEXES OF β-DIKETONES AND/OR POLYPHENOLS BY GREEN CHEMISTRY, PREPARATION METHOD THEREOF, SUNSCREEN THEREOF, SKIN OR HAIR TONE CONCEALER THEREOF, HAIR DYEING THEREOF AND OTHER USES THEREOF | 20180615 |
EP-3807287-A1 | Metal complexes of beta-diketones and/or polyphenols by green chemistry, preparation method thereof, sunscreen thereof, skin or hair tone concealer thereof, hair dyeing thereof and other uses thereof | 20180615 |
US-2021230090-A1 | Metal complexes of b-diketones and/or polyphenols by green chemistry, preparation method thereof, sunscreen thereof, skin or hair tone concealer thereof, hair dyeing thereof and other uses thereof | 20180615 |
TW-201928009-A | --diketonate luminescent material | 20171130 |
US-2019161674-A1 | Europium beta-diketonate luminescent material | 20171130 |
PMID | Publication Date | Title | Journal |
21581258 | 20081108 | 2-(4-Phenyl-3H-1,5-benzodiazepin-2-yl)phenol | Acta crystallographica. Section E, Structure reports online |
15739621 | 20050101 | Design of novel bioisosteres of beta-diketo acid inhibitors of HIV-1 integrase | Antiviral chemistry & chemotherapy |
Complexity: | 305 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.078644241 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.078644241 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 54.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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