1-(4-Methoxyphenyl)-2-phenylethanone - CAS 1023-17-2

Catalog:	BB000836
Product Name:	1-(4-Methoxyphenyl)-2-phenylethanone
CAS:	1023-17-2
Synonyms:	1-(4-methoxyphenyl)-2-phenylethanone; 1-(4-methoxyphenyl)-2-phenylethanone

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(4-methoxyphenyl)-2-phenylethanone
Description:	An intermediate for the synthesis of many biologically active molecules including receptor ligands and enzyme inhibitors.
Molecular Weight:	226.27
Molecular Formula:	C15H14O2
Canonical SMILES:	COC1=CC=C(C=C1)C(=O)CC2=CC=CC=C2
InChI:	InChI=1S/C15H14O2/c1-17-14-9-7-13(8-10-14)15(16)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3
InChI Key:	PLALKSRAHVYFOH-UHFFFAOYSA-N
Boiling Point:	380 °C at 760 mmHg
Density:	1.1 g/cm³
Storage:	Sealed in dry, Room Temperature
MDL:	MFCD00017177
LogP:	3.12060

Publication Number	Title	Priority Date
WO-2020204733-A1	A solvent drying composition and processes therfor	20190403
US-2015119430-A1	Thiazole Compounds and Uses Thereof	20120511
US-9139543-B2	Thiazole compounds and uses thereof	20120511
CN-102617537-A	Preparation method of flocoumafen	20110130
AU-2011329636-A1	Cannabinoid receptor antagonists-inverse agonists useful for treating metabolic disorders, including obesity and diabetes	20101118

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Complexity:	235
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	226.099379685
Formal Charge:	0
Heavy Atom Count:	17
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	226.099379685
Rotatable Bond Count:	4
Topological Polar Surface Area:	26.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2