6-ACETOXY-N-CAPROIC ACID METHYL ESTER


Catalog No:   FT-0642579

CAS No:   104954-58-7

  • Chemical Name:  6-ACETOXY-N-CAPROIC ACID METHYL ESTER
  • Molecular Formula:  C9H16O4
  • Molecular Weight:  188.22
  • InChI Key:  MFIRVMDIUPRJDB-UHFFFAOYSA-N
  • InChI:  InChI=1S/C9H16O4/c1-8(10)13-7-5-3-4-6-9(11)12-2/h3-7H2,1-2H3

Product pricing and availability information
Assay Pack Size Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Product_Name: Methyl 6-Acetoxyhexanoate
Flash_Point: 105.557ºC
Melting_Point: N/A
FW: 188.22100
Density: 1.03
CAS: 104954-58-7
Bolling_Point: 232.781ºC at 760 mmHg
MF: C9H16O4
Molecular_Structure: ['1. Molar refractive index 4729 ', '2. Molar volume 184 ', '3. Parachor (902K)4396 ', '4. Surface tension 325 ', '5. Dielectric constant N/A ', '6. Polarizability 1874 ', '7. Single isotope mass 188104859 Da ', '8. Nominal mass 188 Da ', '9. Average mass 1882209 Da']
LogP: 1.28290
Flash_Point: 105.557ºC
Refractive_Index: 1.427
FW: 188.22100
Density: 1.03
Bolling_Point: 232.781ºC at 760 mmHg
Computational_Chemistry: ['1. XlogP :1 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :8 ', '5. Isotope Atom Count :N/A ', '6. TPSA 526 ', '7. Heavy Atom Count :13 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :165 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
PSA: 52.60000
Exact_Mass: 188.10500
Vapor_Pressure: 0.058mmHg at 25°C
MF: C9H16O4
HS_Code: 2918990090

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