1,3-Dioxane,2-(9-de...

1,3-Dioxane,2-(9-decen-1-yl)-4-methyl- 5445-57-8

1,3-Dioxane,2-(9-decen-1-yl)-4-methyl- 5445-57-8

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  • Purity: 99%
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1,3-Dioxane,2-(9-decen-1-yl)-4-methyl- 5445-57-8 98%

Quick Details

  • Appearance:Solid
  • Application:Organic Chemicals
  • PackAge:as requested
  • ProductionCapacity:100|Kilogram|Month
  • Storage:Room Temperature
  • Transportation:as requested

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Details:

【Name】
1,3-Dioxane,2-(9-decen-1-yl)-4-methyl-
【CAS Registry number】
5445-57-8
【Synonyms】
1,3-Dioxane,2-(9-decenyl)-4-methyl- (9CI)
NSC 22101
【Molecular Formula】
C15H28 O2 (Products with the same molecular formula)
【Molecular Weight】
240.3816
【Inchi】
InChI=1/C15H28O2/c1-3-4-5-6-7-8-9-10-11-15-16-13-12-14(2)17-15/h3,14-15H,1,4-13H2,2H3
【Canonical SMILES】
CC1CCOC(O1)CCCCCCCCC=C
Chemical and Physical Properties
【Density】
0.879g/cm3
【Boiling Point】
279.1°Cat760mmHg
【Refractive Index】
1.443
【Flash Point】
111.6°C
【Computed Properties】
Molecular Weight:240.38162 [g/mol]
Molecular Formula:C15H28O2
XLogP3-AA:5.2
H-Bond Donor:0
H-Bond Acceptor:2
Rotatable Bond Count:9
Exact Mass:240.20893
MonoIsotopic Mass:240.20893
Topological Polar Surface Area:18.5
Heavy Atom Count:17
Formal Charge:0
Complexity:191
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:2
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:2
Feature 3D Hydrophobe Count:1
Feature 3D Ring Count:1
Effective Rotor Count:10.2
Conformer Sampling RMSD:1
CID Conformer Count:363

 

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