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trans,trans-1,4-Diphenyl-1,3-butadiene

trans,trans-1,4-Diphenyl-1,3-butadiene - CAS 538-81-8

Catalog:	BB028384
Product Name:	trans,trans-1,4-Diphenyl-1,3-butadiene
CAS:	538-81-8
Synonyms:	[(1E,3E)-4-phenylbuta-1,3-dienyl]benzene

Technical Data

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Computed Properties

IUPAC Name:	[(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
Description:	trans,trans-1,4-Diphenyl-1,3-butadiene (CAS# 538-81-8) is a useful research chemical.
Molecular Weight:	206.28
Molecular Formula:	C16H14
Canonical SMILES:	C1=CC=C(C=C1)C=CC=CC2=CC=CC=C2
InChI:	InChI=1S/C16H14/c1-3-9-15(10-4-1)13-7-8-14-16-11-5-2-6-12-16/h1-14H/b13-7+,14-8+
InChI Key:	JFLKFZNIIQFQBS-FNCQTZNRSA-N
Boiling Point:	350 °C (lit.)
Density:	1.035 g/cm³
Appearance:	Cream odorless crystalline powder
MDL:	MFCD00004791
LogP:	4.41320
Vapor Pressure:	0.000354 [mmHg]

Publication Number	Title	Priority Date
US-2011218364-A1	Synthesis and Use of Intermetallic Iron Palladium Nanoparticle Compositions	20100305
US-2011197503-A1	Light guiding film and plant growing method using the light guiding film	20100216
US-2011102528-A1	Composition, resist film, pattern forming method, and inkjet recording method	20091030
US-2011233448-A1	Copolymer, rubber composition, cross-linked rubber, cross-linked foam, and uses thereof	20081201
US-2011263879-A1	Zwitterionic phosphonium salts	20080729

PMID	Publication Date	Title	Journal
22544430	20120604	Water-soluble red-emitting distyryl-borondipyrromethene (BODIPY) dyes for biolabeling	Chemistry (Weinheim an der Bergstrasse, Germany)
22028246	20120102	A highly selective colorimetric and fluorescent probe for Cu2+ and Hg2+ ions based on a distyryl BODIPY with two bis(1,2,3-triazole)amino receptors	Chemistry, an Asian journal
21409245	20110428	Preparation of unsymmetrical distyryl BODIPY derivatives and effects of the styryl substituents on their in vitro photodynamic properties	Chemical communications (Cambridge, England)
21365103	20110421	A ratiometric near-infrared pH-responsive fluorescent dye based on distyryl BODIPY	Organic & biomolecular chemistry
21351803	20110324	Medium effects on the direct cis-trans photoisomerization of 1,4-diphenyl-1,3-butadiene in solution	The journal of physical chemistry. A

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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

Complexity:	198
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	2
Exact Mass:	206.109550447
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	206.109550447
Rotatable Bond Count:	3
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	5.5