UCSF

ZINC00215300

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 1st, 2005 9 Yes

Popular Name: 4-(2-Aminoethyl)pyridine 4-(2-Aminoethyl)pyridine

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CAS Numbers: 13258-63-4 , 1654524.0 , 6429-12-5 , [13258-63-4] , [6429-12-5]

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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) -0.37 1.55 -49.35 3 2 1 41 123.179 2 ↓
Lo Low (pH 4.5-6) -0.37 1.83 -93.93 4 2 2 42 124.187 2 ↓

Vendor Notes

Note Type Comments Provided By
BP 104°/9mm Oakwood Chemical
MP 115-116° Matrix Scientific
BP 120 / 17 TCI
BP 121° Matrix Scientific
Boiling_Point 70-71?/1mm Alfa-Aesar
Boiling_Point 70-71°/1mm Alfa-Aesar
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Matrix Scientific
Purity 97% Fluorochem
Purity >95% Fluorochem
Hazard C: Corrosive Acros Organics
H phrase H314: Causes severe skin burns and eye damage Acros Organics
Warnings IRRITANT Matrix Scientific
P phrase 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, if present and easy to do. Continue rinsing Acros Organics
R phrase R34: Causes burns. Acros Organics

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

No pre-computed analogs available. Try a structural similarity search.