Chemical Name: Aloin
Molecular Formula: C21H22O9
Molecular Weight: 418.4
InChI Key: AFHJQYHRLPMKHU-WEZNYRQKSA-N
InChI: InChI=1S/C21H22O9/c22-6-8-4-10-14(21-20(29)19(28)17(26)13(7-23)30-21)9-2-1-3-11(24)15(9)18(27)16(10)12(25)5-8/h1-5,13-14,17,19-26,28-29H,6-7H2/t13-,14-,17-,19+,20-,21+/m1/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

Symbol:	GHS07
CAS:	1415-73-2
Flash_Point:	268.0±26.4 °C
Product_Name:	Aloin
Bolling_Point:	752.6±60.0 °C at 760 mmHg
FW:	418.394
Melting_Point:	148-149ºC
MF:	C21H22O9
Density:	1.6±0.1 g/cm3

Refractive_Index:	1.741
Vapor_Pressure:	0.0±2.6 mmHg at 25°C
Flash_Point:	268.0±26.4 °C
LogP:	1.86
Bolling_Point:	752.6±60.0 °C at 760 mmHg
PSA:	167.91000
Molecular_Structure:	['1. Molar refractive index 10246 ', '2. Molar volume 2539 ', '3. Parachor （902K）8025 ', '4. Surface tension 997 ', '5. Dielectric constant N/A ', '6. Polarizability 4061 ', '7. Single isotope mass 418126382 Da ', '8. Nominal mass 418 Da ', '9. Average mass 418394 Da']
Computational_Chemistry:	['1 . XlogP -01 ', '2 . Hydrogen Bond Donor Count 7 ', '3 . Hydrogen Bond Acceptor Count 9 ', '4 . Rotatable Bond Count 3 ', '5 . Isotope Atom Count 89 ', '6 . TPSA 168 ', '7 . Heavy Atom Count 30 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 630 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 5 ', '12 . Undefined Atom Stereocenter Count 1 ', '13 . Defined Bond Stereocenter Count 0 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 1']
Melting_Point:	148-149ºC
MF:	C21H22O9
Exact_Mass:	418.126373
FW:	418.394
Density:	1.6±0.1 g/cm3
More_Info:	['1 . Appearance Unknow。 ', '2 . Density（g/mL,25/4℃） Unknow ', '3 . Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4 . Melting point（ºC）Unknow ', '5 . Boiling point（ºC,Atmospheric pressure）753 ', '6 . Boiling point（ºC,52kPa） Unknow ', '7 . Refractive index Unknow ', '8 . Flash point（ºC） 268 ', '9 . Specific rotation（º） Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC） Unknow ', '11 . Vapor pressure（kPa,25ºC） 85E-24 ', '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 Insoluble in Water 。']

Symbol:	GHS07
Risk_Statements(EU):	R36/37/38
Personal_Protective_Equipment:	dust mask type N95 (US);Eyeshields;Gloves
RTECS:	LZ6520000
RIDADR:	NONH for all modes of transport
Hazard_Codes:	Xi: Irritant;
Warning_Statement:	P261-P305 + P351 + P338
Safety_Statements:	H315-H319-H335