Molecular Formula: 192.30
Formula Weight: C13H20O
Inchl Key: PSQYTAPXSHCGMF-BQYQJAHWSA-N
Inchl: InChI=1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3/b8-7+

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

Product_Name:	β-Ionone
Flash_Point:	121.3±11.9 °C
Melting_Point:	-49ºC
FW:	192.297
Density:	0.9±0.1 g/cm3
CAS:	14901-07-6
Bolling_Point:	254.8±0.0 °C at 760 mmHg
MF:	C13H20O

Molecular_Structure:	['五分子性质数据 ', '1 . Molar refractive index 6170 ', '2 . Molar volume 2036 ', '3 . Parachor （902K）4903 ', '4 . Surface tension 336 ', '5 . Polarizability 2446']
Flash_Point:	121.3±11.9 °C
Refractive_Index:	1.518
FW:	192.297
Density:	0.9±0.1 g/cm3
Bolling_Point:	254.8±0.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :29 ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :12 ', '6. TPSA 171 ', '7. Heavy Atom Count :14 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :292 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :1 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
LogP:	3.85
Melting_Point:	-49ºC
PSA:	17.07000
MF:	C13H20O
More_Info:	['1. Appearance Colourless to 淡Yellow Liquid ，稀释时有紫罗兰花香气，木香香韵更为突出。 ', '2. Density（g/mL,25/4℃）0945 ', '3相对. Density（20℃，4℃）09461 ', '4. Melting point（ºC）-35 ', '5. Boiling point（ºC,Atmospheric pressure）126~128（16kpa） ', '6常温. Refractive index（n20）15200 ', '7. Refractive index(n20D)152 ', '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 Unknow ', '17. Upper limit of explosion（%,V/V）Unknow ', '18. Lower limit of explosion（%,V/V）Unknow ', '19. Solubility 微Soluble in Water ，Soluble in 油and 醇，以1:3Soluble in 70％ Ethanol ']
Vapor_Pressure:	0.0±0.5 mmHg at 25°C
Exact_Mass:	192.151413

Hazard_Codes:	Xi: Irritant;N: Dangerous for the environment;
Risk_Statements(EU):	R38;R51/53
Packing_Group:	II; III
Hazard_Class:	4.1
RIDADR:	UN 3082
HS_Code:	2914399090
Safety_Statements:	61-36/37/39-27-26