| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 21st, 2008 | 13 | Yes |
Popular Name: 5-amino-2,3-dihydrophthalazine-1,4-dione 5-amino-2,3-dihydrophthalazine-1…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 206658-12-0 , 206658-90-4 , 20666-12-0 , 521-31-3 , 74165-64-3 , [20666-12-0] , [521-31-3]
1,4-phthalazinedione, 5-amino-2,3-dihydro-
3-Amino-phthalhydrazide sodium salt
3-Aminophthalhydrazide monosodium
3-Aminophthalhydrazide monosodium salt
3-Aminophthalhydrazide monosodium salt, 98+%
3-Aminophthalhydrazide sodium salt hemihydrate
3-Aminophthalhydrazide, 98%, pure
5-amino-1,2,3,4-tetrahydrophthalazine-1,4-dione
5-amino-2,3-dihydro-1,4-*phthalazinedione sodium
5-Amino-2,3-dihydro-1,4-phthalazinedione
5-Amino-2,3-dihydro-1,4-phthalazinedione 3-Amino-phthalhydrazide
5-Amino-2,3-dihydro-1,4-phthalazinedione sodium salt
5-Amino-2,3-dihydro-1,4-phthalazinedone
5-Amino-2,3-dihydro-phthalazine-1,4-dione
5-Amino-2,3-dihydrophthalazine-1,4-dione, sodium salt
| 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) | 0.52 | -3.07 | -43.83 | 3 | 5 | -1 | 95 | 176.155 | 0 | ↓ |
| Lo Low (pH 4.5-6) | 0.52 | -3.8 | -8.15 | 4 | 5 | 0 | 92 | 177.163 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 319 - 320 | Acros Organics |
| Melting_Point | 325-330? | Alfa-Aesar |
| Melting_Point | 325-330° | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 98% | Fluorochem |
| biological_use | Also used by biologists in cellular assays for the detection of copper, iron, and cyanides | IBScreen Bioactives |
| biological_use | Antiinflammatories | IBScreen Bioactives IBScreen Bioactives |
| H phrase | H335: May cause respiratory irritation | Acros Organics |
| H phrase | H335: May cause respiratory irritation; H319: Causes serious eye irritation; H315: Causes skin irritation | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray | Acros Organics |
| P phrase | P261: Avoid breathing dust/fume/gas/mist/vapors/spray; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| R phrase | R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| biological_use | Used by forensic investigators to detect trace amounts of blood left at crime scenes | IBScreen Bioactives |
| Hazard | XI: Irritant | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.