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Structure

Methyl 2-ethynylbenzoate

CAS
33577-99-0
Catalog Number
ACM33577990
Category
Other Products
Molecular Weight
160.169320 [g/mol]
Molecular Formula
C10H8O2

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Specification

Synonyms
Methyl 2-ethynylbenzoate, 33577-99-0, NSC649436, benzoic acid, 2-ethynyl-, methyl ester, AC1L86FO, AC1Q43X6, CTK1B8318, LBMDZNOARBBHHG-UHFFFAOYSA-, MolPort-008-155-644, 2-ethynylbenzoic acid methyl ester, 2-METHOXYCARBONYLPHENYLACETYLENE, AKOS005257077, AB65625, AG-A-42307, NSC-649436, RL03237, ORTHOMETHOXYCARBONYLPHENYLACETYLENE, 1-ETHYNYL-2-METHOXYCARBONYLBENZENE, AK-64821, KB-53899
IUPAC Name
methyl 2-ethynylbenzoate
Canonical SMILES
COC(=O)C1=CC=CC=C1C#C
InChI Key
LBMDZNOARBBHHG-UHFFFAOYSA-N
Exact Mass
160.05200
H-Bond Acceptor
2
H-Bond Donor
0

Upstream Synthesis Route 1

  • 1077-79-8
  • 33577-99-0

Reference: [1]Synthetic Communications,1974,vol. 4,p. 25 - 27

Downstream Synthesis Route 1

  • 23084-88-0
  • 33577-99-0
  • 15971-29-6

Reference: [1] Organic Letters, 2004, vol. 6, # 4, p. 605 - 608
[2] Synthesis, 2007, # 13, p. 2014 - 2024

Downstream Synthesis Route 2

  • 111-34-2
  • 33577-99-0
  • 54784-10-0
  • 15971-29-6

Reference: [1] Organic Letters, 2004, vol. 6, # 4, p. 605 - 608
[2] Synthesis, 2007, # 13, p. 2014 - 2024

Downstream Synthesis Route 3

  • 33577-99-0
  • 108-95-2
  • 54063-52-4

Reference: [1] Journal of the American Chemical Society, 2017, vol. 139, # 8, p. 2896 - 2899

Downstream Synthesis Route 4

  • 33577-99-0
  • 544-92-3
  • 151589-37-6

Reference: [1]Tetrahedron Letters,1993,vol. 34,p. 5911 - 5914

Downstream Synthesis Route 5

  • 33577-99-0
  • 27326-44-9

Reference: [1]Journal of Organic Chemistry,1993,vol. 58,p. 6429 - 6437

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

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