| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 8 | Yes |
Popular Name: 1,1-Diethoxyethane 1,1-Diethoxyethane
Find On: PubMed — Wikipedia — Google
CAS Number: 105-57-7
| 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) | 1.38 | 2.92 | -3.28 | 0 | 2 | 0 | 18 | 118.176 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 100 | Acros Organics |
| Melting_Point | 100? | Alfa-Aesar |
| Melting_Point | 100° | Alfa-Aesar |
| Boiling_Point | 101-102? | Alfa-Aesar |
| Boiling_Point | 101-102° | Alfa-Aesar |
| BP [°C] | 103 | Acros Organics |
| MP | 70 - 72 | Enamine Building Blocks |
| MP | 70...72 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Hazard | F: Highly flammable | Acros Organics |
| Hazard | F: Highly flammable; XI: Irritant | Acros Organics |
| H phrase | H319: Causes serious eye irritation | Acros Organics |
| H phrase | H319: Causes serious eye irritation; H315: Causes skin irritation; H225: Highly flammable liquid and vapor | 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.; 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.; S33: Take precautionary measures against static discharges.; S9: Keep container in a well-ventilated place. | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.