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Structure

Myrcene analytical standard

CAS
123-35-3
Catalog Number
ACM123353
Category
Alkenes
Molecular Weight
136.23

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Specification

Hazard Statements
H302
RIDADR
UN 2541 3 / PGIII
Symbol
GHS07
What is the PubChem CID for Myrcene?

PubChem CID 31253

What is the molecular formula of Myrcene?

The molecular formula of Myrcene is C10H16.

What is the molecular weight of Myrcene?

The molecular weight of Myrcene is 136.23 g/mol.

Is Myrcene soluble in water?

No, Myrcene is insoluble in water.

What is the structure of Myrcene?

The structure of Myrcene is a yellow oily liquid with a pleasant odor.

What is the flash point of Myrcene?

The flash point of Myrcene is below 200 °F.

What is the IUPAC name of Myrcene?

The IUPAC name of Myrcene is 7-methyl-3-methylideneocta-1,6-diene.

What is the InChIKey of Myrcene?

The InChIKey of Myrcene is UAHWPYUMFXYFJY-UHFFFAOYSA-N.

What is the canonical SMILES representation of Myrcene?

The canonical SMILES representation of Myrcene is CC(=CCCC(=C)C=C)C.

What is the FEMA number of Myrcene?

The FEMA number of Myrcene is 2762.

Downstream Synthesis Route 1

  • 108-31-6
  • 123-35-3
  • 29811-04-9

Reference: [1]Yang, Xuejuan; Wang, Chunpeng; Li, Shouhai; Huang, Kun; Li, Mei; Mao, Wei; Cao, Shan; Xia, Jianling
[RSC Advances, 2017, vol. 7, # 1, p. 238 - 247]
[2]Diels; Alder
[Justus Liebigs Annalen der Chemie, 1929, vol. 470, p. 103][Justus Liebigs Annalen der Chemie, 1931, vol. 486, p. 216]
[3]Current Patent Assignee: STEPAN CO - US2015/18563, 2015, A1
Location in patent: Paragraph 0084
[4]Hornung, Christian H.; Álvarez-Diéguez, Miguel Á.; Kohl, Thomas M.; Tsanaktsidis, John
[Beilstein Journal of Organic Chemistry, 2017, vol. 13, p. 120 - 126]
[5]Current Patent Assignee: NANTONG XINBANG CHEMICAL - CN107935849, 2018, A
Location in patent: Paragraph 0034; 0041; 0048

Downstream Synthesis Route 2

  • 123-35-3
  • 107-02-8
  • 37677-14-8
  • 52475-89-5

Reference: [1]Mousseron-Canet; Mousseron
[Bulletin de la Societe Chimique de France, 1956, p. 391,395]
Ohloff
[Justus Liebigs Annalen der Chemie, 1957, vol. 606, p. 100,120]
[2]Veselovsky, V. V.; Gybin, A. S.; Lozanova, A. V.; Moiseenkov, A. M.; Smit, W. A.; Caple, R.
[Tetrahedron Letters, 1988, vol. 29, # 2, p. 175 - 178]
[3]Oskooie, Hossein Abdi
[Phosphorus, Sulfur and Silicon and the Related Elements, 2004, vol. 179, # 6, p. 1165 - 1167]
[4]Yin, Donghong; Li, Changzhi; Li, Biaomo; Tao, Liang; Yin, Dulin
[Advanced Synthesis and Catalysis, 2005, vol. 347, # 1, p. 137 - 142]

Downstream Synthesis Route 3

  • 123-35-3
  • 22035-53-6
  • 133475-88-4

Reference: [1]Chapuis
[Tetrahedron Letters, 1991, vol. 32, # 3, p. 355 - 358]

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

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