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539-15-1

Basic Information
CAS No.: 539-15-1
Name: Hordenine
Article Data: 40
Molecular Structure:
Molecular Structure of 539-15-1 (Hordenine)
Formula: C10H15NO
Molecular Weight: 165.235
Synonyms: Eremursine(7CI);Phenol, p-[2-(dimethylamino)ethyl]- (8CI);Anhalin;Anhaline;Cactine;Hordenin;N,N-Dimethyl-4-hydroxy-b-phenethylamine;N,N-Dimethyl-p-hydroxyphenethylamine;N,N-Dimethyltyramine;Ordenina;Peyocactine;p-Hydroxy-N,N-dimethylphenethylamine;p-[2-(Dimethylamino)ethyl]phenol;
EINECS: 208-710-4
Density: 1.026 g/cm3
Melting Point: 117-118°
Boiling Point: 270.2 °C at 760 mmHg
Flash Point: 123.5 °C
Appearance: White crystal
Hazard Symbols: Xn
Risk Codes: 22-36-43
Safety: 26-36/37
PSA: 23.47000
LogP: 1.49630
Synthetic route
50-00-0

formaldehyd

60-19-5

tyramine hydrochloride

539-15-1

N,N-dimethyltyramine

Conditions
ConditionsYield
With palladium 10% on activated carbon; hydrogen; sodium hydrogencarbonate In methanol; water at 20℃;98%
51-67-2

tyrosamine

50-00-0

formaldehyd

539-15-1

N,N-dimethyltyramine

Conditions
ConditionsYield
With hydrogen; palladium on activated charcoal In methanol at 20℃; for 20h; methylation;93%
With hydrogen; palladium on activated charcoal In methanol at 20℃; Methylation;93%
With sodium tris(acetoxy)borohydride In methanol at 20℃; for 18h;70%
14140-15-9

4-(2-bromoethyl)phenol

124-40-3

dimethyl amine

539-15-1

N,N-dimethyltyramine

Conditions
ConditionsYield
In methanol at 20℃;92%
at 20℃; im Rohr;
67-56-1

methanol

51-67-2

tyrosamine

539-15-1

N,N-dimethyltyramine

Conditions
ConditionsYield
With rhodium(III) chloride hydrate; potassium tert-butylate at 150℃; for 60h; Sealed tube; High pressure;76%
With palladium 10% on activated carbon; potassium tert-butylate at 130℃; for 30h;
6027-23-2

2-(4-methoxyphenyl)-N,N-dimethylethylamine hydrochloride

539-15-1

N,N-dimethyltyramine

Conditions
ConditionsYield
With hydrogen bromide at 120 - 130℃;71.54%
14425-64-0

4-methoxyphenethyl bromide

124-40-3

dimethyl amine

539-15-1

N,N-dimethyltyramine

Conditions
ConditionsYield
Stage #1: 4-methoxyphenethyl bromide; dimethyl amine In tetrahydrofuran at 20℃; for 18h;
Stage #2: With water; boron tribromide In hexane; dichloromethane at 0℃; for 0.666667h;
40%
775-33-7

4-methoxyphenethyl-dimethylamine

539-15-1

N,N-dimethyltyramine

Conditions
ConditionsYield
With hydrogenchloride at 160℃;
With phosphorus; hydrogen bromide at 110℃;
With hydrogenchloride at 160℃;
5636-52-2

4-[2-(dimethylamino)ethyl]aniline

539-15-1

N,N-dimethyltyramine

Conditions
ConditionsYield
With sulfuric acid durch Diazotieren;
beim Diazotieren und Verkochen;
1976-98-3

(4-hydroxyphenethyl)trimethylammonium iodide

539-15-1

N,N-dimethyltyramine

Conditions
ConditionsYield
bei der Destillation unter vermindertem Druck;
3761-58-8

candicine chloride

539-15-1

N,N-dimethyltyramine

Conditions
ConditionsYield
bei der Destillation unter vermindertem Druck;
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  • Casno:

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Chemistry

Product Name: 4-(2-Dimethylaminoethyl)phenol (CAS NO.539-15-1)

Molecular Formula: C10H15NO
Molecular Weight: 165.23g/mol
Mol File: 539-15-1.mol
EINECS: 208-710-4
Boiling point: 270.2 °C at 760 mmHg
Flash Point: 123.5 °C
Density: 1.026 g/cm3
Surface Tension: 39.7 dyne/cm
Enthalpy of Vaporization: 52.89 kJ/mol
Vapour Pressure: .00417 mmHg at 25°C
XLogP3-AA: 2.1
H-Bond Donor: 1
H-Bond Acceptor: 2
Structure Descriptors of 4-(2-Dimethylaminoethyl)phenol (CAS NO.539-15-1):
  IUPAC Name: 4-(2-dimethylaminoethyl)phenol
  Canonical SMILES: CN(C)CCC1=CC=C(C=C1)O
  InChI: InChI=1S/C10H15NO/c1-11(2)8-7-9-3-5-10(12)6-4-9/h3-6,12H,7-8H2,1-2H3 
  InChIKey: KUBCEEMXQZUPDQ-UHFFFAOYSA-N
Product Categories: Miscellaneous Natural Products

Specification

 4-(2-Dimethylaminoethyl)phenol , its CAS NO. is 539-15-1, the synonyms are Hordenine ; p-(2-Dimethylaminoethyl)phenol ; Phenol, p-[2-(dimethylamino)ethyl]- .