Chemical Name: JOSAMYCIN
Molecular Formula: C42H69NO15
Molecular Weight: 828.0
InChI Key: XJSFLOJWULLJQS-NGVXBBESSA-N
InChI: InChI=1S/C42H69NO15/c1-23(2)19-32(47)56-40-27(6)53-34(22-42(40,8)50)57-37-26(5)54-41(36(49)35(37)43(9)10)58-38-29(17-18-44)20-24(3)30(46)16-14-12-13-15-25(4)52-33(48)21-31(39(38)51-11)55-28(7)45/h12-14,16,18,23-27,29-31,34-41,46,49-50H,15,17,19-22H2,1-11H3/b13-12+,16-14+/t24-,25-,26-,27+,29+,30+,31-,34+,35-,36-,37-,38+,39+,40+,41+,42-/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

Product_Name:	Josamycin
Flash_Point:	484.7±34.3 °C
Melting_Point:	N/A
FW:	827.995
Density:	1.2±0.1 g/cm3
CAS:	16846-24-5
Bolling_Point:	877.8±65.0 °C at 760 mmHg
MF:	C42H69NO15

Molecular_Structure:	['1 . Molar refractive index 21298 ', '2 . Molar volume （m3/mol）6845 ', '3 . Parachor （902K）18276 ', '4 表面张力（30 dyne/cm）508 ', '5 . Polarizability （05 10 -24cm 3）8443']
LogP:	3.88
Flash_Point:	484.7±34.3 °C
Refractive_Index:	1.535
FW:	827.995
Density:	1.2±0.1 g/cm3
Bolling_Point:	877.8±65.0 °C at 760 mmHg
Computational_Chemistry:	['1. XlogP :29 ', '2. Hydrogen Bond Donor Count 3 ', '3. Hydrogen Bond Acceptor Count 16 ', '4. Rotatable Bond Count :14 ', '5. Isotope Atom Count 2 ', '6. TPSA （T6PSA）:206 ', '7. Heavy Atom Count 58 ', '8. Topological Polar Surface Area 0 ', '9. Complexity :1390 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 16 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 2 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 1']
PSA:	206.05000
MF:	C42H69NO15
More_Info:	['1. Appearance Unknow ', '2. Density（g/mL,25/4℃）1133g/mLat 25°C(lit)3. Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4. Melting point（ºC）Unknow ', '5. Boiling point（ºC,Atmospheric pressure）151-152°C762mm Hg(lit) ', '6. Boiling point（ºC,52kPa）Unknow ', '7. Refractive indexn 20/D 1528(lit)8. Flash point（ºC）110°F9. 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 Unknow']
Vapor_Pressure:	0.0±0.6 mmHg at 25°C
Exact_Mass:	827.466736

Personal_Protective_Equipment:	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
RTECS:	OH4725810
WGK_Germany:	2
RIDADR:	NONH for all modes of transport