CAS 46415-29-6 1-(4-Ethoxyphenyl)piperazine (HCID 231479)

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Basic information

CAS: 46415-29-6
Standard SMILES: CCOc1ccc(N2CCNCC2)cc1
InChIKey: DPEWTQJUUDLJNX-UHFFFAOYSA-N
Molecular formula: C12H18N2O
Average molar mass: 206.28 g/mol
Monoisotopic mass: 206.1419132

Names & identifiers

Preferred name: 1-(4-Ethoxyphenyl)piperazine
IUPAC: 1-(4-ethoxyphenyl)piperazine
English name: 1-(4-Ethoxyphenyl)piperazine
Molecular formula: C12H18N2O
Molecular weight: 206.28

Names & synonyms

1-(4-ethoxyphenyl)piperazine46415-29-6DTXSID00282743RefChem:225112DTXCID802338941-(4-ethoxy-phenyl)-piperazineMFCD001912091-(4-ethoxyphenyl)-piperazinePiperazine,1-(4-ethoxyphenyl)-4-ethoxy-1-piperazinylbenzenen-(4-ethoxyphenyl) piperazineSCHEMBL2155052

Show more names

4-Ethoxyphenylpiperazine4-(4-ethoxyphenyl)piperazinePiperazine, 1-(4-ethoxyphenyl)-1-(4-Ethoxyphenyl)piperazine 97%N-(4-Ethoxyphenyl) piperazine 1-(4-Ethoxyphenyl) piperazine

SCHEMBL4143515DPEWTQJUUDLJNX-UHFFFAOYSA-NAKOS009158776AB04567FS-1656BL008009FE147296DB-024587

Database identifiers

CAS: 46415-29-6
PubChem CID: 231479
DTXSID: DTXSID00282743
EC Number: 674-758-1
Nikkaji: J1.509.775B

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 24.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 3
Heavy atoms: 15
Formal charge: 0
Complexity: 172

Physicochemical properties

Boiling point: 120 °C · 120 °C
Density: 1.04 · 1.040±0.06 g/cm3(Predicted)
pka: 9.02 · 9.02±0.10(Predicted)
CAS DataBase Reference: 46415 · 46415-29-6(CAS DataBase Reference)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 335 · H335-H315-H319
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Hazard Codes: Xi
Hazard Note: Irritant

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
hazard_note: Irritant
Hazard statements: H335-H315-H319
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P