In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 18 | Yes |
Popular Name: 1,4,8,11-Tetramethyl-1,4,8,11-tetraazacyclotetradecane 1,4,8,11-Tetramethyl-1,4,8,11-te…
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CAS Number: 41203-22-9
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) | 0.84 | 3.6 | -86.31 | 2 | 4 | 2 | 15 | 258.454 | 0 | ↓ |
Hi High (pH 8-9.5) | 0.84 | -0.62 | -34.77 | 1 | 4 | 1 | 14 | 257.446 | 0 | ↓ |
Hi High (pH 8-9.5) | 0.84 | -2.2 | -1.1 | 0 | 4 | 0 | 13 | 256.438 | 0 | ↓ |
Mid Mid (pH 6-8) | 0.84 | 5.44 | -190.22 | 3 | 4 | 3 | 17 | 259.462 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 218 | MolMall (formerly Molecular Diversity Preservation International) |
Melting_Point | 34-36? | Alfa-Aesar |
Melting_Point | 34-36° | Alfa-Aesar |
Purity | 97 | Fluorochem |