UCSF

ZINC19230104

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 28th, 2008 10 Yes

Popular Name: 1-(2-methoxyethyl)piperazine 1-(2-methoxyethyl)piperazine

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CAS Numbers: 13484-40-7 , [13484-40-7]

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

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) -0.38 -0.25 -37.4 2 3 1 29 145.226 3 ↓
Hi High (pH 8-9.5) -0.38 -1.58 -3.04 1 3 0 24 144.218 3 ↓

Vendor Notes

Note Type Comments Provided By
BP 101 / 20 TCI
BP [°C] 193 - 194 Acros Organics
Boiling_Point 193-194? Alfa-Aesar
Boiling_Point 193-194° Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks
BP 92-93°/13mm Oakwood Chemical
purity 95 Enamine Building Blocks
Purity 98% Fluorochem
Hazard C: Corrosive Acros Organics
H phrase H314: Causes severe skin burns and eye damage Acros Organics
H phrase H319: Causes serious eye irritation Acros Organics
Warnings IRRITANT Matrix Scientific
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray Acros Organics
P phrase P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water Acros Organics
R phrase R34: Causes burns. Acros Organics
R phrase R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
S phrase S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. Acros Organics
Hazard XI: Irritant Acros Organics

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