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16015-69-3

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Basic Information
CAS No.: 16015-69-3
Name: 1-(3-Trifluoromethylphenyl)piperazine hydrochloride
Molecular Structure:
Molecular Structure of 16015-69-3 (1-(3-Trifluoromethylphenyl)piperazine hydrochloride)
Formula: C11H13F3N2.HCl
Molecular Weight: 266.69
Synonyms: Piperazine, 1-[3-(trifluoromethyl)phenyl]-,monohydrochloride (9CI);Piperazine,1-(a,a,a-trifluoro-m-tolyl)-, monohydrochloride (8CI);
EINECS: 240-153-2
Melting Point: 239-241 °C(lit.)
Boiling Point: 305.9 °C at 760 mmHg
Flash Point: 138.8 °C
Appearance: white solid
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
PSA: 15.27000
LogP: 3.31080
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Chemistry

Product Name: 1-(3-(Trifluoromethyl)phenyl)piperazinium chloride (CAS NO.16015-69-3)

Molecular Formula: C11H14ClF3N2
Molecular Weight: 266.69g/mol
Mol File: 16015-69-3.mol
EINECS: 240-153-2
Melting Point: 239-241 °C(lit.)
Boiling point: 305.9 °C at 760 mmHg
Flash Point: 138.8 °C 
Enthalpy of Vaporization: 54.64 kJ/mol
Vapour Pressure: 0.000797 mmHg at 25°C
H-Bond Donor: 2
H-Bond Acceptor: 5
Structure Descriptors of 1-(3-(Trifluoromethyl)phenyl)piperazinium chloride (CAS NO.16015-69-3):
  IUPAC Name: 1-[3-(trifluoromethyl)phenyl]piperazine hydrochloride
  Canonical SMILES: C1CN(CCN1)C2=CC=CC(=C2)C(F)(F)F.Cl
  InChI: InChI=1S/C11H13F3N2.ClH/c12-11(13,14)9-2-1-3-10(8-9)16-6-4-15-5-7-16;/h1-3,8,15H,4-7H2;1H 
  InChIKey: DGNLGWJZZZOYPT-UHFFFAOYSA-N
Product Categories: Piperidines, Piperidones, Piperazines; PiperazineDerivative; Piperaizine; API intermediates; Aromatics; Heterocycles 

Safety Profile

Safety Information of 1-(3-(Trifluoromethyl)phenyl)piperazinium chloride (CAS NO.16015-69-3):
Hazard Codes: XiIrritant
Risk Statements: 36/37/38  
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
RIDADR: 3276
WGK Germany: 3
Hazard Note: Irritant  

Specification

 1-(3-(Trifluoromethyl)phenyl)piperazinium chloride , its CAS NO. is 16015-69-3, the synonym is 4-[3-(trifluoromethyl)phenyl]piperazin-1-ium chloride .