UCSF

ZINC19230169

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2008 13 Yes

Popular Name: 1-(Tetrahydro-2-furoyl)piperazine 1-(Tetrahydro-2-furoyl)piperazine

Find On: PubMed — Wikipedia — Google

CAS Numbers: 412334-5-6 , 412334-56-6 , 63074-07-7 , 63590-62-5 , [63074-07-7]

Download: MOL2 SDF SMILES Flexibase

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) -0.67 1.12 -11.95 1 4 0 42 184.239 1 ↓

Vendor Notes

Note Type Comments Provided By
Melting_Point 103-107? Alfa-Aesar
BP 116-118°/1mm Oakwood Chemical
BP 116-118°C/1mm Fluorochem
Boiling_Point 120-125?/0.2mm Alfa-Aesar
Boiling_Point 120-125°/0.2mm Alfa-Aesar
BP 125 / 0.2 TCI
BP [°C] 140 (p=1.5 torr) Acros Organics
Purity 98% Fluorochem
Hazard C: Corrosive Acros Organics
H phrase H314: Causes severe skin burns and eye damage Acros Organics
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection Acros Organics
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection; P310: Immediately call a POISON CENTER or doctor/physician; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present Acros Organics
R phrase R34: Causes burns. Acros Organics

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )