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Bosentan

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Bosentan / CAS : 147536-97-8

Appearance Yellowish to grayish white solid UN 0.0
HS 29359000 DG Class 0.0
Synonyms Actelion; 2’-Bipyrimidin)-4-Yl)-Enoxy)(; Benzenesulfonamide,4-(1,1-Dimethylethyl)-N-(6-(2-Hydroxyethoxy)-5-(2-Methoxyph; 4-(Tert-Butyl)-N-(6-(2-Hydroxyethoxy)-5-(2-Methoxyphenoxy)-[2,2'-Bipyrimidin]-4-Yl)Benzenesulf; Bosentan Impurity
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Properties

Summary

Formula
C27H29N5O6S
Molecular Mass
551.61400 英文别名 Bosentan Actelion 2’-Bipyrimidin)-4-Yl)-Enoxy)( Benzenesulfonamide,4-(1,1-Dimethylethyl)-N-(6-(2-Hydroxyethoxy)-5-(2-Methoxyph 4-(Tert-Butyl)-N-(6-(2-Hydroxyethoxy)-5-(2-Methoxyphenoxy)-[2,2'-Bipyrimidin]-4-Yl)Benzenesulf Bosentan Impurity Bosentan (Benzenesulfonamide) Bosentan , Cid 104865 Bosentan, 99%, A Endothelin (Et) Receptor Antagonist 简化分子线性输入规范(SMILES)
Exact Mass
551.18400
PSA
154.03000
Logp
5.35770
IUPAC
4-tert-butyl-N-[6-(2-hydroxyethoxy)-5-(2-methoxyphenoxy)-2-pyrimidin-2-ylpyrimidin-4-yl]benzenesulfonamide Isomeric SMILES: CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=NC=CC=N3)OCCO)OC4=CC=CC=C4OC
SMILES
CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC(=N2)C3=NC=CC=N3)OCCO)OC4=CC=CC=C4OC

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Blood System Drugs
API & Intermediate > Inhibitors

Chemical and Physical Properties

Melting Point
107-110°C
Density
1.325±0.06 g/cm3(Predicted)
Boiling Point
742.3±70.0 °C(Predicted)
Flash Point
402.8ºC
Appearance
Yellowish to grayish white solid

Export information

HS Code
29359000
Export Rebate
13%
UN No.
0.0
DG-Class
0.0
Risk Code
R36; R43
Safety Label
Xi

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