2-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxyacetic acid

Catalog No: FT-0773152

CAS No: 94133-41-2

Chemical Name: 2-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxyacetic acid
Molecular Formula: C12H22O3
Molecular Weight: 214.3 g/mol
InChI Key: CILPHQCEVYJUDN-AXFHLTTASA-N
InChI: InChI=1S/C12H22O3/c1-8(2)10-5-4-9(3)6-11(10)15-7-12(13)14/h8-11H,4-7H2,1-3H3,(H,13,14)/t9-,10+,11-/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

CAS:	94133-41-2
MF:	C12H22O3
Density:	1.01g/cm3
Flash_Point:	122.5ºC
Melting_Point:	N/A
Product_Name:	2-[(1S,2R,5S)-5-methyl-2-propan-2-ylcyclohexyl]oxyacetic acid
Symbol:	GHS07
Bolling_Point:	293.5ºC at 760mmHg
FW:	214.30100

MF:	C12H22O3
Density:	1.01g/cm3
Computational_Chemistry:	['1. XlogP :32 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :4 ', '5. Isotope Atom Count :N/A ', '6. TPSA 465 ', '7. Heavy Atom Count :15 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :213 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :3 ', '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 Colourless 粘稠Liquid ', '2 . Density（g/mL 25ºC）102 ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºCAtmospheric pressure）Unknow ', '5 . Boiling point（ºC）163-164 ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive index（n20/D）Unknow ', '8 . Flash point（ºC，）110 ', '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 （25℃）Unknow ', '17 . Upper limit of explosion（%,V/V）Unknow ', '18 . Lower limit of explosion（%,V/V）Unknow ', '19 . Solubility (mg/mL) Unknow']
Exact_Mass:	214.15700
Flash_Point:	122.5ºC
PSA:	46.53000
Molecular_Structure:	['五分子性质数据 ', '1 . Molar refractive index 5886 ', '2 . Molar volume （m3/mol）2114 ', '3 . Parachor （902K）5154 ', '4 . Surface tension 353 ', '5 . Dielectric constant N/A ', '6 偶极距（10 -24cm 3）N/A ', '7 . Polarizability 2333']
LogP:	2.54840
Bolling_Point:	293.5ºC at 760mmHg
FW:	214.30100
Refractive_Index:	n20/D 1.465(lit.)

Personal_Protective_Equipment:	Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
Symbol:	GHS07
Safety_Statements:	26-36
Warning_Statement:	P261-P305 + P351 + P338
Hazard_Codes:	Xi: Irritant;
HS_Code:	2918990090
RIDADR:	NONH for all modes of transport
Risk_Statements(EU):	36/37/38