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LN2876139

97% , 174227-14-6

CAS NO.:174227-14-6

Empirical Formula: C25H25N5O5S

Molecular Weight: 507.56

MDL number:

Pack Size Price Stock Quantity
100mg RMB655.20 In Stock
250mg RMB1092.00 In Stock
1g RMB2184.00 In Stock
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Update time: 2022-07-08

PRODUCT Properties

Melting point: >218°C (dec.)
Boiling point: 690.0±65.0 °C(Predicted)
Density  1.34±0.1 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  DMSO (Slightly), Chloroform (Slightly), Methanol (Slightly)
form  Solid
pka 4.48±0.50(Predicted)
color  Pale Beige to Light Beige
Major Application pharmaceutical (small molecule)
InChI 1S/C25H25N5O5S/c1-25(2,3)16-10-12-17(13-11-16)36(32,33)30-21-20(35-19-9-6-5-8-18(19)34-4)24(31)29-23(28-21)22-26-14-7-15-27-22/h5-15H,1-4H3,(H2,28,29,30,31)
InChIKey REEANFGHAAWSIZ-UHFFFAOYSA-N
SMILES [S](=O)(=O)(Nc2nc(nc(c2Oc4c(cccc4)OC)O)c3ncccn3)c1ccc(cc1)C(C)(C)C

Description and Uses

O-Deshydroxyethyl Bosentan (Bosentan USP Related Compound B) is an impurity of Bosentan (B675900); a mixed endothelin receptor antagonist. Used as a vasodilator and antihypertensive.

Safety

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
WGK Germany  WGK 3
HS Code  2935909550
Storage Class 11 - Combustible Solids

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