![bis(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-ylmethyl) heptanedioate (CAS: 69271-98-3) - Chemical Structure and Molecular Formula](/static/img/prod_pic/FT-0712261.png "bis(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-ylmethyl) heptanedioate chemical structure")
bis(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-ylmethyl) heptanedioate
Catalog No: FT-0712261
CAS No: 69271-98-3
- Chemical Name: bis(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-ylmethyl) heptanedioate
- Molecular Formula: C37H52O14
- Molecular Weight: 720.8
- InChI Key: LTZRCLYZVSXCTC-UHFFFAOYSA-N
- InChI: InChI=1S/C37H52O14/c38-36(50-28-30-6-8-32-34(26-30)48-24-20-44-16-12-40-10-14-42-18-22-46-32)4-2-1-3-5-37(39)51-29-31-7-9-33-35(27-31)49-25-21-45-17-13-41-11-15-43-19-23-47-33/h6-9,26-27H,1-5,10-25,28-29H2
| 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 |
| CAS: | 69271-98-3 |
|---|---|
| MF: | C37H52O14 |
| Density: | 1.146g/cm3 |
| Flash_Point: | 320.7ºC |
| Melting_Point: | 81-84ºC(lit.) |
| Product_Name: | bis(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-ylmethyl) heptanedioate |
| Symbol: | GHS07 |
| Bolling_Point: | 798.3ºC at 760 mmHg |
| FW: | 720.80000 |
| MF: | C37H52O14 |
|---|---|
| Density: | 1.146g/cm3 |
| Computational_Chemistry: | ['1. XlogP :27 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :14 ', '4. Rotatable Bond Count :12 ', '5. Isotope Atom Count :N/A ', '6. TPSA 145 ', '7. Heavy Atom Count :51 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :839 ', '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'] |
| More_Info: | ['1 . Appearance 米色粉末。 ', '2 . Density（g/mL,25/4℃）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）81-84 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,25ºC）Unknow ', '12 . Saturated vapor pressure（kPa,60ºC）Unknow ', '13 . Combustion heat（KJ/mol）Unknow ', '14 . Critical temperature（ºC）Unknow ', '15 . Critical pressure（KPa）Unknow ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility Unknow 。'] |
| Exact_Mass: | 720.33600 |
| Flash_Point: | 320.7ºC |
| PSA: | 144.90000 |
| Molecular_Structure: | ['1 . Molar refractive index 18278 ', '2 . Molar volume （m3/mol）6288 ', '3 . Parachor （902K）16029 ', '4 . Surface tension 422 ', '5 . Polarizability （10 -24cm 3）7246'] |
| LogP: | 4.06570 |
| Bolling_Point: | 798.3ºC at 760 mmHg |
| FW: | 720.80000 |
| Refractive_Index: | 1.493 |
| Melting_Point: | 81-84ºC(lit.) |
| Personal_Protective_Equipment: | dust mask type N95 (US);Eyeshields;Gloves |
|---|---|
| Symbol: | GHS07 |
| Safety_Statements: | 26-36 |
| Warning_Statement: | P261-P280-P305 + P351 + P338 |
| Hazard_Codes: | Xn |
| Risk_Statements(EU): | 20/21/22-36/37/38 |
| RIDADR: | NONH for all modes of transport |
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