2-(4-methoxyphenyl)...

2-(4-methoxyphenyl)-4-methyl-1,3-dioxane 5420-88-2

2-(4-methoxyphenyl)-4-methyl-1,3-dioxane 5420-88-2

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1 Gram

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  • Min.Order :1 Gram
  • Purity: 99%
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Keywords

2,4-dibromo-6-[[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]phenol 5420-88-2 98%

Quick Details

  • Appearance:Solid
  • Application:Organic Chemicals
  • PackAge:as requested
  • ProductionCapacity:10|Kilogram|Month
  • Storage:Room Temperature
  • Transportation:as requested

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Details:

【Name】
2-(4-methoxyphenyl)-4-methyl-1,3-dioxane
【CAS Registry number】
5420-88-2
【Synonyms】
2-(4-methoxyphenyl)-4-methyl-1,3-dioxane
NSC6608
AC1L5ALW
AC1Q6ZHT
NSC-6608
AR-1C7945
【Molecular Formula】
C12H16O3 (Products with the same molecular formula)
【Molecular Weight】
208.2536
【Inchi】
InChI=1/C12H16O3/c1-9-7-8-14-12(15-9)10-3-5-11(13-2)6-4-10/h3-6,9,12H,7-8H2,1-2H3
【Canonical SMILES】
CC1CCOC(O1)C2=CC=C(C=C2)OC
【MOL File】
5420-88-2.mol
Chemical and Physical Properties
【Density】
1.058g/cm3
【Boiling Point】
309.4°C at 760 mmHg
【Refractive Index】
1.496
【Flash Point】
103.2°C
【Computed Properties】
Molecular Weight:208.25364 [g/mol]
Molecular Formula:C12H16O3
XLogP3-AA:2.1
H-Bond Donor:0
H-Bond Acceptor:3
Rotatable Bond Count:2
Exact Mass:208.109944
MonoIsotopic Mass:208.109944
Topological Polar Surface Area:27.7
Heavy Atom Count:15
Formal Charge:0
Complexity:187
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:3
Feature 3D Ring Count:2
Effective Rotor Count:3.2
Conformer Sampling RMSD:0.6
CID Conformer Count:20

 

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