Molecular Formula: 521.8
Formula Weight: C20H26BrClN2O7
Inchl Key: HGZDFBMYVMPFHR-CYRSAHDMSA-N
Inchl: InChI=1S/C14H13BrClNO7.C6H13N/c15-5-1-4-7(2-6(5)16)17-3-8(4)23-14-11(20)9(18)10(19)12(24-14)13(21)22;7-6-4-2-1-3-5-6/h1-3,9-12,14,17-20H,(H,21,22);6H,1-5,7H2/t9-,10-,11+,12-,14+;/m0./s1

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

FW:	521.787
CAS:	144110-43-0
Melting_Point:	N/A
Bolling_Point:	732.2ºC at 760mmHg
MF:	C20H26BrClN2O7
Product_Name:	5-Bromo-6-chloro-3-indolyl β-D-glucuronide cyclohexylammonium salt
Flash_Point:	396.6ºC
Density:	N/A

FW:	521.787
MF:	C20H26BrClN2O7
LogP:	0.08110
Bolling_Point:	732.2ºC at 760mmHg
Exact_Mass:	520.061157
PSA:	162.71000
Computational_Chemistry:	['1 . XlogP 21 ', '2 . Hydrogen Bond Donor Count 4 ', '3 . Hydrogen Bond Acceptor Count 7 ', '4 . Rotatable Bond Count 2 ', '5 . TPSA 135 ', '6 . Heavy Atom Count 24 ', '7 . Topological Polar Surface Area -1 ', '8 . Complexity 481 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 5 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 1']
Vapor_Pressure:	1.66E-22mmHg at 25°C
Flash_Point:	396.6ºC
Molecular_Structure:	['1. Molar refractive index 无可用 ', '2 . Molar volume 无可用 ', '3 . Parachor （902K）无可用 ', '4 . Surface tension 无可用 ', '5 . Polarizability 无可用']
More_Info:	['1 . Appearance White 结晶性粉末 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）无可用 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用']

Personal_Protective_Equipment:	Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter
RIDADR:	NONH for all modes of transport
WGK_Germany:	3
Safety_Statements:	S22-S24/25