Structure

18-Crown-6

CAS
17455-13-9
Catalog Number
ACM17455139
Category
Other Products
Molecular Weight
264.31g/mol
Molecular Formula
C12H24O6

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Specification

IUPAC Name
1,4,7,10,13,16-hexaoxacyclooctadecane
SMILES
C1COCCOCCOCCOCCOCCO1
InChI
InChI=1S/C12H24O6/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13-1/h1-12H2
InChI Key
XEZNGIUYQVAUSS-UHFFFAOYSA-N
Complexity
108
Covalently-Bonded Unit Count
1
EC Number
241-473-5
Exact Mass
264.157288g/mol
Formal Charge
0
H-Bond Acceptor
6
H-Bond Donor
0
Heavy Atom Count
18
LogP
-0.68 (LogP)
Monoisotopic Mass
264.157288g/mol
NSC Number
159836
Rotatable Bond Count
0
UNII
63J177NC5B
XLogP3
-0.7

Downstream Synthesis Route 1

  • 2032-75-9
  • 17455-13-9
  • 1583-59-1

Reference: [1] Patent: US4895871, 1990, A,

Downstream Synthesis Route 2

  • 17455-13-9
  • 612-23-7
  • 59803-35-9

Reference: [1] Patent: US4408057, 1983, A,

Downstream Synthesis Route 3

  • 17455-13-9
  • 612-23-7
  • 105-53-3
  • 59803-35-9

Reference: [1] Patent: US4368205, 1983, A,

Downstream Synthesis Route 4

  • 17455-13-9
  • 628-36-4
  • 74885-93-1

Reference: [1]Chemische Berichte,1980,vol. 113,p. 2081 - 2085

Downstream Synthesis Route 5

  • 17455-13-9
  • 622-46-8
  • 80027-35-6

Reference: [1]Chemische Berichte,1981,vol. 114,p. 3179 - 3183

Downstream Synthesis Route 6

  • 17455-13-9
  • 33008-06-9
  • 80027-47-0

Reference: [1]Chemische Berichte,1981,vol. 114,p. 3179 - 3183

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

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