TAUROCHENODEOXYCHOLIC ACID SODIUM SALT

Catalog No: FT-0635942

CAS No: 6009-98-9

Chemical Name: TAUROCHENODEOXYCHOLIC ACID SODIUM SALT
Molecular Formula: C26H44NNaO6S
Molecular Weight: 521.7
InChI Key: IYPNVUSIMGAJFC-HLEJRKHJSA-M
InChI: InChI=1S/C26H45NO6S.Na/c1-16(4-7-23(30)27-12-13-34(31,32)33)19-5-6-20-24-21(9-11-26(19,20)3)25(2)10-8-18(28)14-17(25)15-22(24)29;/h16-22,24,28-29H,4-15H2,1-3H3,(H,27,30)(H,31,32,33);/q;+1/p-1/t16-,17+,18-,19-,20+,21+,22-,24+,25+,26-;/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:	Sodium taurochenodeoxycholate
Flash_Point:	195 °F
Melting_Point:	N/A
FW:	521.685
Density:	1.164 g/mL at 25 °C(lit.)
CAS:	6009-98-9
Bolling_Point:	215 °C(lit.)
MF:	C26H44NNaO6S

LogP:	4.52640
Flash_Point:	195 °F
Refractive_Index:	n20/D 1.558(lit.)
FW:	521.685
Density:	1.164 g/mL at 25 °C(lit.)
Bolling_Point:	215 °C(lit.)
Computational_Chemistry:	['1 . XlogP ', '2 . Hydrogen Bond Donor Count 3 ', '3 . Hydrogen Bond Acceptor Count 6 ', '4 . Rotatable Bond Count 7 ', '5 . Isotope Atom Count 2 ', '6 . TPSA 127 ', '7 . Heavy Atom Count 35 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 864 ', '10 . Isotope Atom Count 0 ', '11 . Defined Atom Stereocenter Count 0 ', '12 . Undefined Atom Stereocenter Count 10 ', '13 . Defined Bond Stereocenter Count 0 ', '14 . Undefined Bond Stereocenter Count 0 ', '15 . Covalently-Bonded Unit Count 2']
PSA:	135.14000
MF:	C26H44NNaO6S
More_Info:	['1 . Appearance 结晶。有吸湿性 ', '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）Unknow ', '6 . Boiling point（ºC,52kPa）Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point（ºC）Unknow ', '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 Soluble in Water 。']
Exact_Mass:	521.278687