UCSF

ZINC12360067

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 9th, 2008 15 Yes

Popular Name: 1,3-Bis(4-piperidyl)propane 1,3-Bis(4-piperidyl)propane

Find On: PubMed — Wikipedia — Google

CAS Numbers: 16898-52-5 , 17252-51-6 , 31951-46-9 , [16898-52-5]

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) 2.14 -2.59 -81.91 4 2 2 33 212.381 4 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 327? Alfa-Aesar
Boiling_Point 327° Alfa-Aesar
Melting_Point 63-68? Alfa-Aesar
Melting_Point 63-68° Alfa-Aesar
MP 65 - 69 Enamine Building Blocks
MP 65...69 Enamine Building Blocks
MP 66 TCI
MP 66° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific

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