CAS
79885-37-3 Purity
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79885-37-3 Purity
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4-Hexylphenylacetylene
CAS
79887-11-9
Catalog Number
ACM79887119
Category
Other Products
Molecular Weight
186.29
Molecular Formula
C14H18
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Specification
Synonyms
1-Ethynyl-4-hexylbenzene, 1-Eth-1-ynyl-4-hexylbenzene, 79887-11-9, 4-Hexyl-1-ethynylbenzene, SBB055171, 4-ethynyl-1-hexylbenzene, 1-ethynyl-4-hexyl-benzene, 4-Hexylphenylacetylene, ACMC-209pie, 4-n-Hexylphenylacetylene, AC1MCQ03, CTK6D7634, MolPort-000-141-934, ANW-37332, ZINC02555805, AKOS006228247, AG-A-19739, MCULE-4279488872, RP03468, AK109251
IUPAC Name
1-ethynyl-4-hexylbenzene
Canonical SMILES
CCCCCCC1=CC=C(C=C1)C#C
InChI Key
NFPDFDTYANKKIU-UHFFFAOYSA-N
Boiling Point
263.5ºC at 760 mmHg
Flash Point
105.6ºC
Density
0.9 g/cm³
Appearance
yellow liquid
Exact Mass
186.14100
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
0
H-Bond Donor
0
Safety Description
26-36/37/39
Upstream Synthesis Route 1
- 166964-87-0
- 79887-11-9
Reference: [1]Meng, H.-H. B.; Dalton, L. R.; Wu, S.-T.
[Molecular Crystals and Liquid Crystals Science and Technology, Section A: Molecular Crystals and Liquid Crystals, 1994, vol. 250, p. 303 - 314]
Downstream Synthesis Route 1
- 87-82-1
- 79887-11-9
- 125594-06-1
Reference: [1]Praefcke, Klaus; Kohne, Bernd; Singer, Dirk
[Angewandte Chemie, 1990, vol. 102, # 2, p. 200 - 202]
Downstream Synthesis Route 2
- 79887-11-9
- 125962-61-0
- 1026853-58-6
Reference: [1]Zhang, Yifan; Schuster, Gary B.
[Journal of Organic Chemistry, 1994, vol. 59, # 7, p. 1855 - 1862]
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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