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Structure

1H-Imidazole,5-ethynyl-1-methyl-

CAS
71759-92-7
Catalog Number
ACM71759927
Category
Other Products
Molecular Weight
106.13
Molecular Formula
C6H6N2

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Specification

Synonyms
5-Ethynyl-1-methyl-1H-imidazole, 71759-92-7, AG-G-81573, AC1MNTA1, 5-ethynyl-1-methylimidazole, 578711_ALDRICH, CTK5D4999, MolPort-003-937-303, 1H-Imidazole,5-ethynyl-1-methyl-, ACN-C001074, ANW-71919, AKOS015916325, RP00447, 5-ETHYNYL-1-METHYL-1H-IMIDAZOL, AK-61919, AB1003753, KB-245876, Y9902, I14-51095, 1-Methyl-5-ethynylimidazole;5-Ethynyl-1-methyl-1H-imidazole;5-Ethynyl-1-methylimidazole;
IUPAC Name
5-ethynyl-1-methylimidazole
Canonical SMILES
CN1C=NC=C1C#C
InChI Key
JFOSWQQRTHDTGG-UHFFFAOYSA-N
Boiling Point
116ºC25 mm Hg(lit.)
Flash Point
220 °F
Density
1.045 g/mL at 25ºC(lit.)
Exact Mass
106.05300
Hazard Statements
Xn: Harmful;
H-Bond Acceptor
1
H-Bond Donor
0
Safety Description
26-36/39

Upstream Synthesis Route 1

  • 1066-54-2
  • 71759-88-1
  • 71759-92-7

Reference: [1]Chemical and pharmaceutical bulletin,1987,vol. 35,p. 823 - 828

Downstream Synthesis Route 1

  • 814-49-3
  • 71759-92-7
  • 912486-04-5

Reference: [1]Lecercle, Delphine; Sawicki, Marcin; Taran, Frederic
[Organic Letters, 2006, vol. 8, # 19, p. 4283 - 4285]

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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