3',5'-DICHLORO-2'-HYDROXYACETOPHENONE

Product Information

Molecular Formula:
C8H6Cl2O2
Molecular Weight:
205.04
Description
Antioxidant
Synonyms
2-Acetyl-4,6-dichlorophenol; 2'-Hydroxy-3',5'-dichloroacetophenone; 4,6-Dichloro-2-acetylphenol; Acetophenone, 3',5'-dichloro-2'-hydroxy-; Ethanone, 1-(3,5-dichloro-2-hydroxyphenyl)-; 1-(3,5-DICHLORO-2-HYDROXYPHENYL)ETHAN-1-ONE; 1-(3,5-DICHLORO-2-HYDROXYPHENYL
IUPAC Name
1-(3,5-dichloro-2-hydroxyphenyl)ethanone
Canonical SMILES
CC(=O)C1=C(C(=CC(=C1)Cl)Cl)O
InChI
InChI=1S/C8H6Cl2O2/c1-4(11)6-2-5(9)3-7(10)8(6)12/h2-3,12H,1H3
InChI Key
CJFYGRLJDKWMDI-UHFFFAOYSA-N
Boiling Point
132-134 °C/18 mmHg(lit.)
Flash Point
235.4 °F
Purity
N/A
Density
1.43g/cm3
Appearance
powder
Refractive Index
n20/D 1.479 (lit.)

Computed Properties

XLogP3
3.1
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
1
Exact Mass
203.9744848 g/mol
Monoisotopic Mass
203.9744848 g/mol
Topological Polar Surface Area
37.3Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
184
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
WO-2021257518-A1 Fluorosilicone polymers, compositions, and uses thereof 2020-06-15
WO-2021195701-A1 Aligned fibres and a method of making the same 2020-03-31
WO-2021158704-A1 Methods for microwave synthesis of degradable polymers for drug delivery 2020-02-03
WO-2021151154-A1 A non-invasive continuous blood glucose monitor 2020-01-29
CN-113766874-A Non-invasive continuous blood glucose monitor 2020-01-29
WO-2020223536-A1 Substituted cyclolakyls as modulators of the integrated stress pathway 2019-04-30
TW-202106671-A Modulators of the integrated stress pathway 2019-04-30
AU-2020266592-A1 Substituted cyclolakyls as modulators of the integrated stress pathway 2019-04-30
CA-3138144-A1 Substituted cyclolakyls as modulators of the integrated stress pathway 2019-04-30
EP-3962899-A1 Substituted cyclolakyls as modulators of the integrated stress pathway 2019-04-30

Literatures

PMID Publication Date Title Journal
21589412 2010-11-10 (E)-2,4-Dichloro-6-{1-[(2-chloro-eth-yl)imino]-eth-yl}phenol Acta crystallographica. Section E, Structure reports online
21587638 2010-09-30 N'-[(E)-1-(3,5-Dichloro-2-hy-droxy-phen-yl)ethyl-idene]-4-meth-oxy-benzo-hydrazide monohydrate Acta crystallographica. Section E, Structure reports online
21578353 2009-10-17 2,4-Dichloro-6-((1R)-1-{[(R)-(2-chloro-phen-yl)(cyclo-pent-yl)meth-yl]amino}eth-yl)phenol Acta crystallographica. Section E, Structure reports online
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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