Structure

7-Octen-1-ol

CAS
13175-44-5
Catalog Number
ACM13175445
Category
Other Products
Molecular Weight
128.21
Molecular Formula
C8H16O

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Specification

Synonyms
ACMC-1C0UJ; EINECS 236-122-8; ANW-19385; AC1L34XN; ZINC2569624; AS-47640; DTXSID50157194; MFCD00798076; octa-7-en-1-ol; AC1Q7CP5;
IUPAC Name
oct-7-en-1-ol;
Canonical SMILES
C=CCCCCCCO;
InChI
InChI=1S/C8H16O/c1-2-3-4-5-6-7-8-9/h2,9H,1,3-8H2;
InChI Key
WXPWPYISTQCNDP-UHFFFAOYSA-N;
Complexity
59.6
Covalently-Bonded Unit Count
1
EC Number
236-122-8
Exact Mass
128.12g/mol
H-Bond Acceptor
1
H-Bond Donor
1
Heavy Atom Count
9
Monoisotopic Mass
128.12g/mol
Rotatable Bond Count
6
Topological Polar Surface Area
20.2A^2
Undefined Atom Stereocenter Count
1

Downstream Synthesis Route 1

  • 13175-44-5
  • 10160-24-4

Reference: [1] Chemistry of Natural Compounds, 1982, vol. 18, # 2, p. 219 - 224[2] Khimiya Prirodnykh Soedinenii, 1982, vol. 18, # 2, p. 239 - 245
[3] Tetrahedron Letters, 1979, vol. No.50, p. 4851 - 4854

Downstream Synthesis Route 2

  • 13175-44-5
  • 3710-42-7

Reference: [1] Synlett, 2016, vol. 27, # 2, p. 245 - 248

Downstream Synthesis Route 3

  • 13175-44-5
  • 871-90-9

Reference: [1] Patent: JP2016/169192, 2016, A, . Location in patent: Paragraph 0022

Downstream Synthesis Route 4

  • 13175-44-5
  • 21573-31-9

Reference: [1]Baeck, Marcus; Johansson, Per-Ola; Wangsell, Fredrik; Thorstensson, Fredrik; Kvarnstroem, Ingemar; Ayesa, Susana; Waehling, Horst; Pelcman, Mikael; Jansson, Katarina; Lindstroem, Stefan; Wallberg, Hans; Classon, Bjoern; Rydergard, Christina; Vrang, Lotta; Hamelink, Elizabeth; Hallberg, Anders; Rosenquist, Asa; Samuelsson, Bertil
[Bioorganic and Medicinal Chemistry, 2007, vol. 15, # 22, p. 7184 - 7202]

Downstream Synthesis Route 5

  • 13175-44-5
  • 2695-48-9

Reference: [1]Angewandte Chemie - International Edition,2017,vol. 56,p. 4342 - 4346
Angew. Chem.,2017,vol. 129,p. 4406 - 4410,5

Downstream Synthesis Route 6

  • 13175-44-5
  • 35897-55-3
  • 21573-31-9

Reference: [1]Mihailovic, M. Lj.; Konstantinovic, S.; Vukicevic, R.
[Tetrahedron Letters, 1986, vol. 27, # 20, p. 2287 - 2290]

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

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