2-(Triphenylphosphoranylidene)acetophenone - CAS 859-65-4

Name: 2-(Triphenylphosphoranylidene)acetophenone
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB037787
Product Name:	2-(Triphenylphosphoranylidene)acetophenone
CAS:	859-65-4
Synonyms:	1-phenyl-2-triphenylphosphoranylideneethanone; 1-phenyl-2-(triphenyl-$l^{5}-phosphanylidene)ethanone

Technical Data

IUPAC Name:	1-phenyl-2-(triphenyl-λ5-phosphanylidene)ethanone
Description:	2-(Triphenylphosphoranylidene)acetophenone (CAS# 859-65-4) is a useful research chemical.
Molecular Weight:	380.42
Molecular Formula:	C26H21OP
Canonical SMILES:	C1=CC=C(C=C1)C(=O)C=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI:	InChI=1S/C26H21OP/c27-26(22-13-5-1-6-14-22)21-28(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-21H
InChI Key:	MZRSAJZDYIISJW-UHFFFAOYSA-N
Boiling Point:	550.9 °C at 760 mmHg
Density:	1.18 g/cm³
Appearance:	White to slightly pale yellow
LogP:	4.66560

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
US-2021171436-A1	Highly enantioselective access to cyclic beta-amino acids	20191204
WO-2021045085-A1	Curable resin composition, dry film and cured product of same, and electronic component containing said cured product	20190906
WO-2020241370-A1	Screen printing plate and method for manufacturing same	20190527
US-2020095258-A1	Functionalized heterocycles as antiviral agents	20180921
US-10865211-B2	Functionalized heterocycles as antiviral agents	20180921

Complexity:	489
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	380.133002287
Formal Charge:	0
Heavy Atom Count:	28
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	380.133002287
Rotatable Bond Count:	5
Topological Polar Surface Area:	17.1 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	5.2