In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 20th, 2007 | 14 | Yes |
Popular Name: (1-benzyl-1H-1,2,3-triazol-4-yl)methanol (1-benzyl-1H-1,2,3-triazol-4-yl)…
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CAS Numbers: 103755-58-4 , 28798-81-4 , [28798-81-4]
1-Phenyl-1H-1,2,3-triazole-4-methanol, 97%
1H-1,2,3-triazole-4-methanol, 1-(phenylmethyl)-
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) | 1.02 | 2.2 | -9.76 | 1 | 4 | 0 | 51 | 189.218 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 74 - 76 | KeyOrganics |
MP | 74-76° | Matrix Scientific |
MP | 80 - 82 | Enamine Building Blocks |
MP | 80...82 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Purity | 97% | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |