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1,4-Diphenylbutadiyne
[CAS# 886-65-7]

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Identification
Classification Chemical reagent >> Organic reagent >> Aromatic hydrocarbon reagent
Name 1,4-Diphenylbutadiyne
Synonyms St5034860; Ab-016/30004035; 1,1'-(1E,3E)-Buta-1,3-Diene-1,4-Diyldibenzene
Molecular Structure CAS#: 886-65-7, 1,4-Diphenylbutadiyne
Molecular Formula C16H14
Molecular Weight 206.29
CAS Registry Number 886-65-7
EINECS 212-952-6
SMILES C2=C(\C=C\C=C\C1=CC=CC=C1)C=CC=C2
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+
InChIKey JFLKFZNIIQFQBS-FNCQTZNRSA-N
Properties
Density 1.035g/cm3 (Cal.)
Melting point 152°C (Expl.)
Boiling point 350°C (Expl.)
367.016°C at 760 mmHg (Cal.)
Flash point 189.93°C (Cal.)
Safety Data
SDS Available
References
(1) J. Saltiel, O. Dmitrenko, Z. S. Pillai, R. Klima, S. Wang, T. Wharton, Z.-N. Huang, L. J. van de Burgt and J. Arranz. Triplet and ground state potential energy surfaces of 1,4-diphenyl-1,3-butadiene: theory and experiment, Photochem. Photobiol. Sci., 2008, 7, 566.
Market Analysis Reports
List of Reports Available for 1,4-Diphenylbutadiyne
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