| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2006 | 14 | Yes |
Popular Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamine 1-(3,4-dihydro-2H-1,5-benzodioxe…
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CAS Numbers: 1170067-06-7 , 1212386-50-9 , 876709-21-6 , [876709-21-6]
(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethan-1-amine
1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethan-1-amine
1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanamine hydrochloride
1-(3,4-Dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-ethyl amine
1-(3,4-Dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-ethylamine
1-(3,4-Dihydro-2H-benzo[b][1,4]dioxepin-7-yl)ethanamine
| 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) | -0.42 | 3.21 | -49.23 | 3 | 3 | 1 | 46 | 194.254 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 166 - 168 | Enamine Building Blocks |
| MP | 166...168 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
