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BIS(CIS-3,3,5-TRIMETHYLCYCLOHEXYL) PHTHALATE

Catalog No: FT-0644104

CAS No: 245652-81-7

Chemical Name: BIS(CIS-3,3,5-TRIMETHYLCYCLOHEXYL) PHTHALATE
Molecular Formula: C26H38O4
Molecular Weight: 414.6
InChI Key: ATHBXDPWCKSOLE-VNTMZGSJSA-N
InChI: InChI=1S/C26H38O4/c1-17-11-19(15-25(3,4)13-17)29-23(27)21-9-7-8-10-22(21)24(28)30-20-12-18(2)14-26(5,6)16-20/h7-10,17-20H,11-16H2,1-6H3/t17-,18-,19+,20+/m0/s1

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Base Information
Chemical Information

Product_Name:	bis[(1S,5S)-3,3,5-trimethylcyclohexyl] benzene-1,2-dicarboxylate
Flash_Point:	219.7ºC
Melting_Point:	93ºC
FW:	414.57800
Density:	1.06g/cm3
CAS:	245652-81-7
Bolling_Point:	466.4ºC at 760 mmHg
MF:	C26H38O4

LogP:	6.42980
Flash_Point:	219.7ºC
Refractive_Index:	1.525
FW:	414.57800
Density:	1.06g/cm3
Bolling_Point:	466.4ºC at 760 mmHg
Computational_Chemistry:	['1. XlogP :78 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 526 ', '7. Heavy Atom Count :30 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :569 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :4 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point:	93ºC
PSA:	52.60000
MF:	C26H38O4
More_Info:	['1 . Appearance Unknow ', '2 . Density（g/mL20 ºC）Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）93 ', '5 . Boiling point（ºC,Atmospheric pressure）Unknow ', '6 . Boiling point（ºC3mmHg）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（º C3mmHg）Unknow ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（kPa,）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']
Vapor_Pressure:	7.13E-09mmHg at 25°C
Exact_Mass:	414.27700