Tetraphenylcyclopentadienone - CAS 479-33-4

Name: Tetraphenylcyclopentadienone
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB026437
Product Name:	Tetraphenylcyclopentadienone
CAS:	479-33-4
Synonyms:	2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-one

Technical Data

IUPAC Name:	2,3,4,5-tetraphenylcyclopenta-2,4-dien-1-one
Description:	Tetraphenylcyclopentadienone (CAS# 479-33-4) is a building block for several organic and organometallic compounds. It is also used as an efficient cyclone system or in re-circulation systems for the capturing of fine active pharmaceuticals and food ingredients.
Molecular Weight:	384.47
Molecular Formula:	C29H20O
Canonical SMILES:	C1=CC=C(C=C1)C2=C(C(=O)C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C5=CC=CC=C5
InChI:	InChI=1S/C29H20O/c30-29-27(23-17-9-3-10-18-23)25(21-13-5-1-6-14-21)26(22-15-7-2-8-16-22)28(29)24-19-11-4-12-20-24/h1-20H
InChI Key:	PLGPSDNOLCVGSS-UHFFFAOYSA-N
Boiling Point:	617.1 °C at 760 mmHg
Density:	1.199 g/cm³
Appearance:	Black powder
LogP:	6.79110

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Complexity:	613
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	384.151415257
Formal Charge:	0
Heavy Atom Count:	30
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	384.151415257
Rotatable Bond Count:	4
Topological Polar Surface Area:	17.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	6.4