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144110-43-0

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Basic Information
CAS No.: 144110-43-0
Name: 5-Bromo-6-chloro-3-indolyl-D-glucuronide cyclohexylammonium salt
Molecular Structure:
Molecular Structure of 144110-43-0 (5-Bromo-6-chloro-3-indolyl-D-glucuronide cyclohexylammonium salt)
Formula: C14H13BrClNO7.C6H13N
Molecular Weight: 521.79
Synonyms: MAGENTA(TM)-BETA-D-GLUCURONIDE CYCLOHEXYLAMMONIUM SALT;MAGENTA(TM)-BETA-D-GLCA CHX;MAGENTAR-BETA-D-GLUCURONIDE, CYCLOHEXYLAMMONIUM SALT;MAGENTA-BETA-D-GLCA;MAGENTA-BETA-D-GLUCURONIDE CHX-SALT;MAGENTA GLCA CYCLOHEXYLAMMONIUM SALT;MAGENTA-GLUCURO CHA SALT;MAGENTA GLUCURONIDE
EINECS: 1533716-785-6
Density: g/cm3
Boiling Point: 732.2°Cat760mmHg
Flash Point: 396.6°C
Solubility: Soluble in DMF. Soluble in water
Appearance: white to off-white crystalline powder
Safety: 22-24/25
PSA: 162.71000
LogP: 0.08110
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Chemistry

Molecule structure of 5-Bromo-6-chloro-3-indolyl-D-glucuronide cyclohexylammonium salt (CAS NO.144110-43-0):

Systematic Name: Cyclohexanamine - 5-bromo-6-chloro-1H-indol-3-yl beta-D-glucopyranosiduronic acid (1:1) 
Molecular Formula: C14H13BrClNO7.C6H13N
Molecular Weight: 521.79 g/mol 
CAS Registry Number: 144110-43-0
Storage temp.: 2-8°C
Flash Point: 396.6 °C
Enthalpy of Vaporization: 112.16 kJ/mol
Boiling Point: 732.2 °C at 760 mmHg
Vapour Pressure: 1.66E-22 mmHg at 25 °C 
SMILES: Clc3cc2c(c(O[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]1O)cn2)cc3Br.NC1CCCCC1
InChI: InChI=1/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
InChIKey: HGZDFBMYVMPFHR-CYRSAHDMBX
Std. InChI: 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
Std. InChIKey of 5-Bromo-6-chloro-3-indolyl-D-glucuronide cyclohexylammonium salt (CAS NO.144110-43-0): HGZDFBMYVMPFHR-CYRSAHDMSA-N 

Safety Profile

Safety Statements: 22-24/25 
S22:Do not breathe dust. 
S24/25:Avoid contact with skin and eyes.
WGK Germany: 3
F: 3-10

Specification

 5-Bromo-6-chloro-3-indolyl-D-glucuronide cyclohexylammonium salt (CAS NO.144110-43-0) is also named as Magenta(TM)-beta-D-glucuronide cyclohexylammonium salt ; Magenta(TM)-beta-D-glca chx ; Magentar-beta-D-glucuronide, cyclohexylammonium salt ; Magenta-beta-D-glca ; magenta-beta-D-glucuronide chx-salt ; Magenta glca cyclohexylammonium salt ; Magenta-glucuro cha salt ; Magenta glucuronide . 5-Bromo-6-chloro-3-indolyl-D-glucuronide cyclohexylammonium salt (CAS NO.144110-43-0) is white to off-white crystalline powder.