Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

6-Benzylamino-1-(4'-phenylbutoxy)hexane
Related Products

Hot Products

Basic Information Post buying leads Suppliers Cas Database
Name

6-Benzylamino-1-(4'-phenylbutoxy)hexane

 EINECS 692-628-2
CAS No. 97664-55-6 Density 0.979 g/cm3
PSA 21.26000 LogP 5.76700
Solubility N/A Melting Point N/A
Formula C23H33NO Boiling Point 467.238 °C at 760 mmHg
Molecular Weight 339.521 Flash Point 207.26 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 97664-55-6 (6-N-Benzylamino-1-(4'-phenylbutoxy)Hexane) Hazard Symbols N/A
Synonyms

N-Benzyl-6-(4-phenylbutoxy)hexan-1-amine;[6-(4-Phenylbutoxy)hexyl]benzylamine;6-Benzylamino-1-(4'-phenylbutoxy)hexane;

Article Data 7

6-Benzylamino-1-(4'-phenylbutoxy)hexane Synthetic route

94749-73-2

6-bromohexyl 4-phenylbutyl ether

100-46-9

benzylamine

97664-55-6

N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine

Conditions
ConditionsYield
Stage #1: benzylamine With triethylamine; potassium iodide In acetonitrile at 45℃;
Stage #2: 6-bromohexyl 4-phenylbutyl ether In acetonitrile		76%
With triethylamine; sodium iodide75%
With triethylamine; sodium iodide In dimethyl sulfoxide for 17h; Ambient temperature;70%
With caesium carbonate In N,N-dimethyl-formamide at 60 - 80℃; for 5h;38%
100-52-7

benzaldehyde

97664-58-9

D 2543

97664-55-6

N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine

Conditions
ConditionsYield
With sodium tetrahydroborate; molecular sieve 2.) ethanol; Yield given. Multistep reaction;
629-03-8

1 ,6-dibromohexane

97664-55-6

N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 51 percent / NaOH; tetra-n-butylammonium hydrogen sulphate; benzyltrimethylammonium chloride / CH2Cl2; H2O / 192 h / 20 °C
2: 38 percent / Cs2CO3 / dimethylformamide / 5 h / 60 - 80 °C
View Scheme
Multi-step reaction with 4 steps
1: 60 percent
2: NaN3 / dimethylformamide
3: lithium aluminum hydride
4: 1.) mol. sieves; 2.) NaBH4 / 2.) ethanol
View Scheme
Multi-step reaction with 2 steps
1: potassium hydroxide; tetrabutylammomium bromide / toluene / 10 h / 20 °C
2: triethylamine; potassium iodide / acetonitrile / 45 °C
View Scheme
3360-41-6

4-phenyl-butan-1-ol

97664-55-6

N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 51 percent / NaOH; tetra-n-butylammonium hydrogen sulphate; benzyltrimethylammonium chloride / CH2Cl2; H2O / 192 h / 20 °C
2: 38 percent / Cs2CO3 / dimethylformamide / 5 h / 60 - 80 °C
View Scheme
Multi-step reaction with 2 steps
1: 81 percent / NaH / tetrahydrofuran / 7 h / Ambient temperature
2: 70 percent / Et3N, NaI / dimethylsulfoxide / 17 h / Ambient temperature
View Scheme
Multi-step reaction with 4 steps
1: 60 percent
2: NaN3 / dimethylformamide
3: lithium aluminum hydride
4: 1.) mol. sieves; 2.) NaBH4 / 2.) ethanol
View Scheme
Multi-step reaction with 2 steps
1: potassium hydroxide; tetrabutylammomium bromide / toluene / 10 h / 20 °C
2: triethylamine; potassium iodide / acetonitrile / 45 °C
View Scheme
Multi-step reaction with 3 steps
1.1: sodium hydroxide / 2 h / 60 °C
1.2: 4 h / 110 °C
2.1: triethylamine / toluene / 5 h / 5 - 10 °C
3.1: sodium hydroxide / toluene / 12 h / 110 °C
View Scheme
629-03-8

1 ,6-dibromohexane

sodium-compound of (+-)-cyclopenten-(2)-yl-malonic acid diethyl ester

sodium-compound of (+-)-cyclopenten-(2)-yl-malonic acid diethyl ester

97664-55-6

N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 81 percent / NaH / tetrahydrofuran / 7 h / Ambient temperature
2: 70 percent / Et3N, NaI / dimethylsulfoxide / 17 h / Ambient temperature
View Scheme
94749-73-2

6-bromohexyl 4-phenylbutyl ether

97664-55-6

N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: NaN3 / dimethylformamide
2: lithium aluminum hydride
3: 1.) mol. sieves; 2.) NaBH4 / 2.) ethanol
View Scheme
168412-89-3

1-azido-6-(4-phenylbutoxy)hexane

97664-55-6

N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: lithium aluminum hydride
2: 1.) mol. sieves; 2.) NaBH4 / 2.) ethanol
View Scheme

N-[6-(4-phenylbutoxy)hexyl] benzenemethanamine hydrochloride

97664-55-6

N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine

Conditions
ConditionsYield
With sodium carbonate In dichloromethane; water at 25 - 30℃; for 0.5h; pH=~ 8;
135235-81-3

6-(4-phenylbutyloxy)hexyl methanesulfonate

100-46-9

benzylamine

97664-55-6

N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine

Conditions
ConditionsYield
With sodium hydroxide In toluene at 110℃; for 12h;
629-11-8

1,6-hexanediol

97664-55-6

N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1.1: sodium hydroxide / 2 h / 60 °C
1.2: 4 h / 110 °C
2.1: triethylamine / toluene / 5 h / 5 - 10 °C
3.1: sodium hydroxide / toluene / 12 h / 110 °C
View Scheme

6-Benzylamino-1-(4'-phenylbutoxy)hexane Specification

The 6-Benzylamino-1-(4'-phenylbutoxy)hexane, with the CAS registry number 97664-55-6, is also known as [6-(4-Phenylbutoxy)hexyl]benzylamine. This chemical's molecular formula is C23H33NO and molecular weight is 339.51. What's more, its systematic name is N-Benzyl-6-(4-phenylbutoxy)-1-hexanamine. 

Physical properties of 6-Benzylamino-1-(4'-phenylbutoxy)hexane are: (1)ACD/LogP: 5.729; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.66; (4)ACD/LogD (pH 7.4): 3.44; (5)ACD/BCF (pH 5.5): 11.31; (6)ACD/BCF (pH 7.4): 68.46; (7)ACD/KOC (pH 5.5): 26.48; (8)ACD/KOC (pH 7.4): 160.29; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 14; (12)Polar Surface Area: 21.26 Å2; (13)Index of Refraction: 1.531; (14)Molar Refractivity: 107.325 cm3; (15)Molar Volume: 346.692 cm3; (16)Polarizability: 42.547×10-24cm3; (17)Surface Tension: 38.2 dyne/cm; (18)Density: 0.979 g/cm3; (19)Flash Point: 207.26 °C; (20)Enthalpy of Vaporization: 72.918 kJ/mol; (21)Boiling Point: 467.238 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(CCCCc1ccccc1)CCCCCCNCc2ccccc2
(2)Std. InChI: InChI=1S/C23H33NO/c1(10-18-24-21-23-16-7-4-8-17-23)2-11-19-25-20-12-9-15-22-13-5-3-6-14-22/h3-8,13-14,16-17,24H,1-2,9-12,15,18-21H2
(3)Std. InChIKey: JWLIKZBRVQRFNF-UHFFFAOYSA-N 

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 97664-55-6