Benzene,1-(diethoxy...

Benzene,1-(diethoxymethyl)-2-[(2-methyl-2-propen-1-yl)oxy]- 5436-69-1

Benzene,1-(diethoxymethyl)-2-[(2-methyl-2-propen-1-yl)oxy]- 5436-69-1

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1 Kilogram

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  • Purity: 99%
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Benzene,1-(diethoxymethyl)-2-[(2-methyl-2-propen-1-yl)oxy]- 5436-69-1 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】
Benzene,1-(diethoxymethyl)-2-[(2-methyl-2-propen-1-yl)oxy]-
【Iupac name】
1-(diethoxymethyl)-2-(2-methylprop-2-enoxy)benzene
【CAS Registry number】
5436-69-1
【Synonyms】
Benzene,1-(diethoxymethyl)-2-[(2-methyl-2-propenyl)oxy]- (9CI)
NSC 21758
【Molecular Formula】
C15H22 O3 (Products with the same molecular formula)
【Molecular Weight】
0
【Inchi】
InChI=1/C15H22O3/c1-5-16-15(17-6-2)13-9-7-8-10-14(13)18-11-12(3)4/h7-10,15H,3,5-6,11H2,1-2,4H3
【Canonical SMILES】
CCOC(C1=CC=CC=C1OCC(=C)C)OCC
【MOL File】
5436-69-1.mol
Chemical and Physical Properties
【Density】
0.986g/cm3
【Boiling Point】
321.9°Cat760mmHg
【Refractive Index】
1.49
【Flash Point】
107.7°C
【Computed Properties】
Molecular Weight:250.33338 [g/mol]
Molecular Formula:C15H22O3
XLogP3-AA:3.5
H-Bond Donor:0
H-Bond Acceptor:3
Rotatable Bond Count:8
Exact Mass:250.156895
MonoIsotopic Mass:250.156895
Topological Polar Surface Area:27.7
Heavy Atom Count:18
Formal Charge:0
Complexity:234
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:3
Feature 3D Ring Count:1
Effective Rotor Count:8
Conformer Sampling RMSD:0.8
CID Conformer Count:87

 

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