1-Benzyl-4-phenylpiperazine supplier

Name
1-BENZYL-4-PHENYLPIPERAZINE
EINECS
CAS No. 3074-46-2
Article Data22
CAS DataBase
Density 1.092 g/cm³
Solubility
Melting Point 42 °C
Formula C₁₇H₂₀N₂
Boiling Point 376.1 °C at 760 mmHg
Molecular Weight 252.359
Flash Point 167.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Piperazine,1-benzyl-4-phenyl- (7CI,8CI);
PSA 6.48000
LogP 3.01170

Synthetic route

polymer, polymerization degree = 50; monomer(s): (1S,2R,6S,7R)-4-benzyl-4-thionia-tricyclo[5.2.1.02,6]dec-8-ene perchlorate: polymer, polymerization degree = 50; monomer(s): (1S,2R,6S,7R)-4-benzyl-4-thionia-tricyclo[5.2.1.02,6]dec-8-ene perchlorate

: 92-54-6
4-phenyl-1-piperazine

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With caesium carbonate; sodium iodide In dichloromethane at 80℃; for 1h;	98%

: 92-54-6
4-phenyl-1-piperazine

: 100-52-7
benzaldehyde

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
Stage #1: 4-phenyl-1-piperazine; benzaldehyde for 0.0666667h; Microwave irradiation; Stage #2: With sodium tetrahydroborate In methanol at 20℃; for 0.5h;	98%
With sodium cyanoborohydride; acetic acid In methanol; 1,2-dichloro-ethane at 65℃; for 0.166667h; Flow reactor;

: 92-54-6
4-phenyl-1-piperazine

silica-supported oligomeric benzyl phosphate: silica-supported oligomeric benzyl phosphate

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With caesium carbonate; sodium iodide In tetrahydrofuran at 80℃; for 12h; Inert atmosphere; Sealed tube;	95%

: 92-54-6
4-phenyl-1-piperazine

polymer, degree of polymerization 60; monomer(s): 2-chlorosulfonyl-5-norbornene; ethyl vinyl ether; benzyl alcohol: polymer, degree of polymerization 60; monomer(s): 2-chlorosulfonyl-5-norbornene; ethyl vinyl ether; benzyl alcohol

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With triethylamine In dichloromethane at 40℃;	94%

: 92-54-6
4-phenyl-1-piperazine

: 100-39-0
benzyl bromide

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
In dimethyl sulfoxide	89%
With sodium carbonate In acetonitrile at 20℃;	84%
With aluminum oxide; potassium carbonate for 0.0833333h; Solid phase reaction; alkylation; microwave irradiation;	74%

: 50-00-0
formaldehyd

: 108-86-1
bromobenzene

: 92-54-6
4-phenyl-1-piperazine

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With cobalt(II) bromide; zinc In acetonitrile at 60℃; for 1.5h; Mannich type reaction; Inert atmosphere;	89%

...Expand

: 92-54-6
4-phenyl-1-piperazine

: 100-44-7
benzyl chloride

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With potassium carbonate In butanone at 80℃; for 24h;	82%
With toluene

: 92-54-6
4-phenyl-1-piperazine

: 100-51-6
benzyl alcohol

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With iron(III)phthalocyanine chloride; potassium tert-butylate In neat (no solvent) at 170℃; for 24h; Inert atmosphere; Microwave irradiation;	82%

: 280-57-9
1,4-diaza-bicyclo[2.2.2]octane

: 591-50-4
iodobenzene

: 100-39-0
benzyl bromide

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With copper(l) iodide; potassium tert-butylate In dimethyl sulfoxide at 65℃; for 4h; Solvent; Temperature; Inert atmosphere;	79%

...Expand

: 280-57-9
1,4-diaza-bicyclo[2.2.2]octane

: 591-50-4
iodobenzene

: 100-44-7
benzyl chloride

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With copper(l) iodide; potassium tert-butylate In dimethyl sulfoxide at 65℃; for 4h; Inert atmosphere;	78%

...Expand

: 280-57-9
1,4-diaza-bicyclo[2.2.2]octane

: 108-86-1
bromobenzene

: 100-39-0
benzyl bromide

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With copper(l) iodide; potassium tert-butylate In dimethyl sulfoxide at 65℃; for 4h; Inert atmosphere;	75%

...Expand

: 280-57-9
1,4-diaza-bicyclo[2.2.2]octane

: 108-86-1
bromobenzene

: 100-44-7
benzyl chloride

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With copper(l) iodide; potassium tert-butylate In dimethyl sulfoxide at 65℃; for 4h; Inert atmosphere;	74%

...Expand

: 112253-26-6
2-(4-benzyl-piperazin-1-yl)-benzaldehyde

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With [ruthenium(II)(η6-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]2; (1S)-10-camphorsulfonic acid In toluene at 140℃; under 760.051 Torr; for 18h; Sealed tube; Molecular sieve;	11%

: 108-86-1
bromobenzene

: 2759-28-6
1-phenylmethylpiperazine

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With palladium diacetate; sodium t-butanolate; DavePhos In toluene at 110℃; for 20h;	96 % Chromat.

: 92-54-6
4-phenyl-1-piperazine

: 1233656-18-2
C16H19O4P

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
Stage #1: C16H19O4P With Grubbs catalyst first generation In dichloromethane at 50℃; Inert atmosphere; Stage #2: 4-phenyl-1-piperazine With tetra-(n-butyl)ammonium iodide; potassium carbonate In chloroform at 80℃; Inert atmosphere;

: 100-44-7
benzyl chloride

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: neat (no solvent) / 0.25 h 2: lithium tert-butoxide; copper(l) chloride / 1-methyl-pyrrolidin-2-one / 14 h / 70 °C View Scheme

: 17763-67-6
Phenyl triflate

: 42790-42-1
4-aza-1-benzylazoniabicyclo<2.2.2>octane chloride

: 3074-46-2
N-benzyl,N'-phenylpiperazine

Conditions

Conditions	Yield
With copper(l) chloride; lithium tert-butoxide In 1-methyl-pyrrolidin-2-one at 70℃; for 14h;

: 3074-46-2
N-benzyl,N'-phenylpiperazine

: 206753-52-8
4-benzyl-1-phenylpiperazine-2,3-dione

Conditions

Conditions	Yield
Stage #1: N-benzyl,N'-phenylpiperazine With sodium dihydrogenphosphate; 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical In acetonitrile at 0℃; for 0.0833333h; Stage #2: With sodium hypochlorite; sodium chlorite In water; acetonitrile	75%

: 3074-46-2
N-benzyl,N'-phenylpiperazine

: 155721-36-1
2-(4-methoxyphenyl)-1-tosylaziridine

A: C33H37N3O3S

B: C33H37N3O3S

Conditions

Conditions	Yield
With tetrakis(actonitrile)copper(I) hexafluorophosphate; (S)-(1,1'-binaphthalene)-2,2'-diylbis(diphenylphosphine) In toluene at 23℃; for 36h; Inert atmosphere; Overall yield = 88 %; Overall yield = 48.8 mg;	A n/a B n/a

...Expand

1-Benzyl-4-phenylpiperazine Specification

The 1-Benzyl-4-phenylpiperazine, with the CAS registry number 3074-46-2, is also known as Piperazine, 1-phenyl-4-(phenylmethyl)-. It belongs to the product categories of Piperaizine; Piperazines. This chemical's molecular formula is C₁₇H₂₀N₂ and molecular weight is 252.3541. Its IUPAC name is called 1-benzyl-4-phenylpiperazine.

Physical properties of 1-Benzyl-4-phenylpiperazine: (1)ACD/LogP: 3.30; (2)ACD/LogD (pH 5.5): 2.44; (3)ACD/LogD (pH 7.4): 3.27; (4)ACD/BCF (pH 5.5): 26.16; (5)ACD/BCF (pH 7.4): 175.93; (6)ACD/KOC (pH 5.5): 204.99; (7)ACD/KOC (pH 7.4): 1378.36; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 3; (10)Index of Refraction: 1.601; (11)Molar Refractivity: 79.19 cm³; (12)Molar Volume: 231 cm³; (13)Surface Tension: 45.7 dyne/cm; (14)Density: 1.092 g/cm³; (15)Flash Point: 167.1 °C; (16)Enthalpy of Vaporization: 62.38 kJ/mol; (17)Boiling Point: 376.1 °C at 760 mmHg; (18)Vapour Pressure: 7.4E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CN(CCN1CC2=CC=CC=C2)C3=CC=CC=C3
(2)InChI: InChI=1S/C17H20N2/c1-3-7-16(8-4-1)15-18-11-13-19(14-12-18)17-9-5-2-6-10-17/h1-10H,11-15H2
(3)InChIKey: VEJWDLHOLWGRLH-UHFFFAOYSA-N

Product Name

1-BENZYL-4-PHENYLPIPERAZINE

Synthetic route

1-Benzyl-4-phenylpiperazine Specification

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