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3-[3-Acetyl-4-[3-(Tert-Butylamino)-2-Hydroxypropoxy]Phenyl]-1,1-Diethylurea

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3-[3-Acetyl-4-[3-(Tert-Butylamino)-2-Hydroxypropoxy]Phenyl]-1,1-Diethylurea / CAS : 56980-93-9

Appearance solid UN -
HS 29242100 DG Class -
Synonyms Ul/1677; Ccris 3400; 3-<3-Acetyl-4-(3-Tert-Butylamino-2-Hydroxy-Propoxy)-Phenyl>-1,1-Diethylharnstoff; Celectol; Einecs 260-497-7; Celiprololum [Inn-Latin]; Celiprolol; N'-(3-Acetyl-4-(3-((1,1-Dimethylethyl)-Amino)-2-Hydroxypropoxy)-Phenyl)-N,N-Diethylurea; N-[3-Acetyl-4-(3'-Tert-Butylamino-2'-Hydroxy)Propoxy]-Phenyl-N'-Diethylurea; Rhc-5320A; [14C]-Celiprolol; Selectol
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Properties

Summary

Formula
C20H33N3O4
Molecular Mass
379.49400
Exact Mass
379.24700
PSA
90.90000
Logp
3.35460
IUPAC
3-[3-acetyl-4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-1,1-diethylurea
SMILES
CCN(CC)C(=O)NC1=CC(=C(C=C1)OCC(CNC(C)(C)C)O)C(=O)C

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Raw Materials

Chemical and Physical Properties

Melting Point
110-112°C
Density
1.114 g/cm3
Boiling Point
84-86°C/0.4mm
Flash Point
84-86°C/0.4mm
Appearance
solid
Acidity and Basicity
alkalinity

Export information

HS Code
29242100
Export Rebate
13%
Risk Code
R36/37/38
Safety Label
Xn

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