diethyl 2-hexyl-2-p...

diethyl 2-hexyl-2-phenylmalonate 5243-35-6

diethyl 2-hexyl-2-phenylmalonate 5243-35-6

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1 Gram

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  • Min.Order :1 Gram
  • Purity: 99%
  • Payment Terms : L/C,T/T,

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diethyl 2-hexyl-2-phenyl-propanedioate 5243-35-6 98%

Quick Details

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

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4.Customs Synthesis
 
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Details:

Identification and Related Records

【Name】
diethyl hexyl(phenyl)propanedioate
【CAS Registry number】
5243-35-6
【Synonyms】
diethyl hexyl(phenyl)propanedioate
NSC19013
AC1L5FHT
AC1Q63R0
AR-1I4708
NSC-19013
diethyl 2-hexyl-2-phenylpropanedioate
【Molecular Formula】
C19H28O4 (Products with the same molecular formula)
【Molecular Weight】
320.4232
【Inchi】
InChI=1/C19H28O4/c1-4-7-8-12-15-19(17(20)22-5-2,18(21)23-6-3)16-13-10-9-11-14-16/h9-11,13-14H,4-8,12,15H2,1-3H3
【Canonical SMILES】
CCCCCCC(C1=CC=CC=C1)(C(=O)OCC)C(=O)OCC
【MOL File】
5243-35-6.mol

Chemical and Physical Properties

【Density】
1.028g/cm3
【Boiling Point】
392.9°C at 760 mmHg
【Refractive Index】
1.488
【Flash Point】
184.9°C
【Computed Properties】
Molecular Weight:320.42322 [g/mol]
Molecular Formula:C19H28O4
XLogP3-AA:5.4
H-Bond Donor:0
H-Bond Acceptor:4
Rotatable Bond Count:12
Exact Mass:320.198759
MonoIsotopic Mass:320.198759
Topological Polar Surface Area:52.6
Heavy Atom Count:23
Formal Charge:0
Complexity:340
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:2
Feature 3D Hydrophobe Count:3
Feature 3D Ring Count:1
Effective Rotor Count:12
Conformer Sampling RMSD:1
CID Conformer Count:89
 

 

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