| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 9th, 2008 | 8 | No |
Popular Name: Diacetyl dioxime Diacetyl dioxime
Find On: PubMed — Wikipedia — Google
CAS Numbers: 13478-93-8 , 75006-64-3 , 95-45-4 , [60908-54-5] , [95-45-4]
(E)-N-[(3E)-3-(hydroxyimino)butan-2-ylidene]hydroxylamine
Dimethylglyoxime Disodium Salt Octahydrate
Dimethylglyoxime, 99+%, ACS reagent
Dimethylglyoxime, disodium salt octahydrate, 99%
N-methoxy-1-nitroso-1-propen-2-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) | 0.30 | -2.23 | -5.3 | 2 | 4 | 0 | 65 | 116.12 | 1 | ↓ |
| Ref Reference (pH 7) | 0.30 | -2.6 | -6.94 | 2 | 4 | 0 | 65 | 116.12 | 1 | ↓ |
| Ref Reference (pH 7) | 1.09 | -0.73 | -23 | 2 | 4 | 0 | 62 | 116.12 | 2 | ↓ |
| Ref Reference (pH 7) | 1.09 | -0.82 | -14.39 | 2 | 4 | 0 | 62 | 116.12 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 239 - 242 | Acros Organics |
| MP | 240 | TCI |
| MP | 240 - 241 | Enamine Building Blocks |
| MP | 240...241 | Enamine Building Blocks |
| Melting_Point | 250? subl. | Alfa-Aesar |
| Melting_Point | 250° subl. | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Melting_Point | ca 240? dec. | Alfa-Aesar |
| Melting_Point | ca 240° dec. | Alfa-Aesar |
| Hazard | F: Highly flammable | Acros Organics |
| Hazard | F: Highly flammable; XN: Harmful | Acros Organics |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation | Acros Organics |
| H phrase | H332: Harmful if inhaled | Acros Organics |
| H phrase | H332: Harmful if inhaled; H302: Harmful if swallowed; H312: Harmful in contact with skin; H228: Flammable solid | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P302 + P352: IF ON SKIN: Wash with plenty of soap and water; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P304 + P340: IF INHALED: R | Acros Organics |
| P phrase | P302+ P352: IF ON SKIN: Wash with plenty of soap and water | Acros Organics |
| P phrase | P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present | Acros Organics |
| R phrase | R11: Highly flammable. | Acros Organics |
| R phrase | R11: Highly flammable.; R20/21/22: Harmful by inhalation, in contact with skin and if swallowed. | Acros Organics |
| R phrase | R36/38: Irritating to eyes and skin. | Acros Organics |
| S phrase | S16: Keep away from sources of ignition - No smoking. | Acros Organics |
| S phrase | S16: Keep away from sources of ignition - No smoking.; S36/37: Wear suitable protective clothing and gloves. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39: Wear suitable gloves and eye/face protection. | Acros Organics |
| Hazard | XI: Irritant | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.