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40004-08-8

40004-08-8 Structure

40004-08-8 Structure
IdentificationMore
[Name]

1-(ETHOXYCARBONYLMETHYL)PIPERAZINE
[CAS]

40004-08-8
[Synonyms]

1-(ETHOXYCARBONYLMETHYL)PIPERAZINE
2-(PIPERAZIN-1-YL)-ACETIC ACID ETHYL ESTER
AKOS BBS-00006885
AKOS BC-0535
ETHYL 1-PIPERAZINEACETATE
ETHYL 2-(PIPERAZIN-1-YL)ACETATE
ETHYL PIPERAZIN-1-YLACETATE
ETHYL PIPERAZINOACETATE
N-(CARBOETHOXYMETHYL)-PIPERAZINE
N-(Carboethoxymethyl)piperazine~Ethyl (1-piperazino)acetate~(1-Piperazino)acetic acid ethyl ester
ethyl piperazine-1-acetate
ethyl (1-piperazino)acetate
1-Piperazineaceticacid,ethylester(7CI,9CI)
2-(PIPERAZIN-1-YL)-ACETIC ACID ETHYL ESTER >97%
1-(Ethoxycarbonylmethyl)piperazine, N-(Carboethoxymethyl)-piperazine, Ethyl 1-piperazineacetate
1-Piperazineacetic acid ethyl ester
[EINECS(EC#)]

254-745-3
[Molecular Formula]

C8H16N2O2
[MDL Number]

MFCD00040739
[Molecular Weight]

172.22
[MOL File]

40004-08-8.mol
Chemical PropertiesBack Directory
[Boiling point ]

127°C 13mm
[density ]

1.048 g/mL at 20 °C(lit.)
[refractive index ]

n20/D 1.472
[Fp ]

127°C/13mm
[storage temp. ]

-20°C
[solubility ]

Chloroform, Methanol
[form ]

Oil
[pka]

8.96±0.10(Predicted)
[color ]

Clear
[Water Solubility ]

Soluble in water, chloroform, and methanol.
[Sensitive ]

Air Sensitive
[BRN ]

743260
[Major Application]

peptide synthesis
[InChI]

1S/C8H16N2O2/c1-2-12-8(11)7-10-5-3-9-4-6-10/h9H,2-7H2,1H3
[InChIKey]

MTFCXMJOGMHYAE-UHFFFAOYSA-N
[SMILES]

CCOC(=O)CN1CCNCC1
[CAS DataBase Reference]

40004-08-8(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P261-P264-P271-P280-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

8
[HS Code ]

2933599590
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

1-(ETHOXYCARBONYLMETHYL)PIPERAZINE is Clear Thick Oil
[Uses]

1-(ETHOXYCARBONYLMETHYL)PIPERAZINE is used in the preparation of aralkylpiperazine- and aryl-substituted hydrazines, particularly benzylpiperazineacetyl hydrazones of hydroxyaryl aldehydes, as selecti ve inducers of apoptosis and activators of procaspases for use as anticancer agents.
[Uses]

N-(Ethoxycarbonylmethyl)piperazine is used in the preparation of aralkylpiperazine- and aryl-substituted hydrazines, particularly benzylpiperazineacetyl hydrazones of hydroxyaryl aldehydes, as selective inducers of apoptosis and activators of procaspases for use as anticancer agents.
[Definition]

ChEBI: Ethyl piperazinoacetate is an alpha-amino acid ester.
[reaction suitability]

reaction type: solution phase peptide synthesis
[Synthesis]

Step A: tert-butyl 4-ethoxycarbonylmethyl-piperazine-1-carboxylate

Tert-butyl piperazine-1-carboxylate (2.62 g, 14 mmol), cesium carbonate (5 g, 15 mmol) and bromoacetic acid ethyl ester (1.56 ml, 14 mmol) were stirred at room temperature for 1

Spectrum DetailBack Directory
[Spectrum Detail]

1-(ETHOXYCARBONYLMETHYL)PIPERAZINE(40004-08-8)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

Ethyl 1-piperazineacetate, 96%(40004-08-8)
[Sigma Aldrich]

40004-08-8(sigmaaldrich)
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40004-08-8