| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2008 | 16 | Yes |
Popular Name: N'-Benzo[1,3]-dioxol-5-ylmethyl-N,N-dimethylethanediamine N'-Benzo[1,3]-dioxol-5-ylmethyl-…
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CAS Numbers: , 128120-68-3 , 500566-88-1
(2H-1,3-benzodioxol-5-ylmethyl)[2-(dimethylamino)ethyl]amine
1,2-ethanediamine, N'-(1,3-benzodioxol-5-ylmethyl)-N,N-dimethyl-, dihydrochloride
BENZODIOXOLYLMETHYLDIMETHYLETHANEDIAMIN
BENZODIOXOLYLMETHYLDIMETHYLETHANEDIAMINEDIHYDROCHLORID
N'-(1,3-benzodioxol-5-ylmethyl)-N,N-dimethylethane-1,2-diamine
N'-(1,3-benzodioxol-5-ylmethyl)-N,N-dimethylethane-1,2-diamine dihydrochloride
N'-Benzo[1,3]dioxol-5-ylmethyl-N,N-dimethyl-ethane-1,2-diamine
N'-Benzo[1,3]dioxol-5-ylmethyl-N,N-dimethyl-ethane-1,2-diamine dihydrochloride
N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(dimethylamino)ethyl]amine
| 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) | 1.42 | 2.74 | -46.45 | 2 | 4 | 1 | 38 | 223.296 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.42 | 3.88 | -39.63 | 2 | 4 | 1 | 35 | 223.296 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
