FT-0614016 CAS:116-02-9 chemical structure

3,3,5-Trimethylcyclohexanol

Name: 3,3,5-Trimethylcyclohexanol
Rating: 4.5 (11 reviews)

Catalog No: FT-0614016

CAS No: 116-02-9

Molecular Formula: 142.24
Formula Weight: C9H18O
Inchl Key: BRRVXFOKWJKTGG-UHFFFAOYSA-N
Inchl: InChI=1S/C9H18O/c1-7-4-8(10)6-9(2,3)5-7/h7-8,10H,4-6H2,1-3H3

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Melting_Point:	30-32ºC
CAS:	116-02-9
MF:	C9H18O
Flash_Point:	73.2±10.9 °C
Product_Name:	3,3,5-Trimethylcyclohexanol
Density:	0.9±0.1 g/cm3
FW:	142.239
Bolling_Point:	187.7±8.0 °C at 760 mmHg

Refractive_Index:	1.448
Vapor_Pressure:	0.2±0.8 mmHg at 25°C
Flash_Point:	73.2±10.9 °C
LogP:	2.87
Bolling_Point:	187.7±8.0 °C at 760 mmHg
FW:	142.239
PSA:	20.23000
Computational_Chemistry:	['1. XlogP :26 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :0 ', '5. Isotope Atom Count :N/A ', '6. TPSA 202 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :118 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :2 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point:	30-32ºC
MF:	C9H18O
Exact_Mass:	142.135757
Molecular_Structure:	['五分子性质数据 ', '1 . Molar refractive index 4329 ', '2 . Molar volume 1618 ', '3 . Parachor （902K）3693 ', '4 . Surface tension 271 ', '5 . Polarizability 1716']
Density:	0.9±0.1 g/cm3
More_Info:	['1 . Appearance Colourless Liquid 。 ', '2 . Density（g/mL,20℃）086 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）30-32 ', '5 . Boiling point（ºC,Atmospheric pressure）193-196 ', '6 . Boiling point（ºC, KPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）81 ', '9 . Specific rotation（º）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（mmHg, ºC）Unknow ', '12 . Saturated vapor pressure（kPa, ºC）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']