UCSF

ZINC00066094

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 3rd, 2005 13 Yes

Popular Name: 1-(4-Fluorophenyl)piperazine 1-(4-Fluorophenyl)piperazine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 16141-90-5 , 2252-63-3 , 55752-58-4 , 64090-19-3 , [2252-63-3] , [64090-19-3]

Download: MOL2 SDF SMILES Flexibase

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.50 3.42 -44.42 2 2 1 20 181.234 1 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 120?/0.1mm Alfa-Aesar
Boiling_Point 120°/0.1mm Alfa-Aesar
melting_point 231 - 234 KeyOrganics
Melting_Point 30-33? Alfa-Aesar
Melting_Point 30-33° Alfa-Aesar
Purity 95+% Matrix Scientific
Purity 98% APIChem
Purity 99% Fluorochem
Hazard C: Corrosive Acros Organics
Melting_Point ca 234? dec. Alfa-Aesar
MP ca 234° dec Matrix Scientific
Melting_Point ca 234° dec. Alfa-Aesar
H phrase H314: Causes severe skin burns and eye damage Acros Organics
H phrase H314: Causes severe skin burns and eye damage; H302: Harmful if swallowed Acros Organics
Warnings IRRITANT Matrix Scientific
P phrase P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting Acros Organics
P phrase P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, Acros Organics
R phrase R22: Harmful if swallowed.; R34: Causes burns. Acros Organics
R phrase R34: Causes burns. Acros Organics
S phrase S23: Do not breathe gas/fumes/vapour/spray. Acros Organics
Warnings Toxic Matrix Scientific

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