UCSF

ZINC19735609

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 8th, 2008 16 Yes

Popular Name: 1-(2-N-Boc-Aminoethyl)piperazine 1-(2-N-Boc-Aminoethyl)piperazine

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CAS Numbers: 140447-78-5 , [140447-78-5]

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) 0.46 0.4 -44.83 3 5 1 58 230.332 5 ↓

Vendor Notes

Note Type Comments Provided By
BP 357° Matrix Scientific
MP 64° Matrix Scientific
Purity 95% Fluorochem
Purity 97% Fluorochem
H phrase H302: Harmful if swallowed; H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory irritation Acros Organics
Warnings IRRITANT Matrix Scientific
Warnings Irritant/Store in Freezer Matrix Scientific
P phrase P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P304 + P340: IF INHALED: Remove to fresh air and keep at rest in a position comfortable for breathing; P305 + P35 Acros Organics
R phrase R22: Harmful if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. Acros Organics
Hazard XN: Harmful Acros Organics

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