| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 8 | No |
Popular Name: 2,2'-Dithiodiethanol 2,2'-Dithiodiethanol
2-hydroxyethyldisulfide; CPD0-1885; dithiodiglycol
Bis(2-hydroxyethyl) Disulfide (ca. 50% in Water)
| 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) | 0.07 | -0.83 | -4.28 | 2 | 2 | 0 | 40 | 154.256 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP [°C] | 158 - 163 (p=3.5 torr) | Acros Organics |
| Boiling_Point | 158-163?/3.5mm | Alfa-Aesar |
| Boiling_Point | 158-163°/3.5mm | Alfa-Aesar |
| Mp [°C] | 25 - 27 | Acros Organics |
| ALOGPS_SOLUBILITY | 3.65e+01 g/l | DrugBank-experimental |
| Melting_Point | ca 25? | Alfa-Aesar |
| Melting_Point | ca 25° | Alfa-Aesar |
| UniProt Database Links | GSTL1_ARATH; GSTL2_ARATH; YFCG_ECOLI; YGHU_ECOLI; YQJG_ECOLI | ChEBI |
| H phrase | H311: Toxic in contact with skin | Acros Organics |
| H phrase | H311: Toxic in contact with skin; H331: Toxic if inhaled; H301: Toxic if swallowed; H318: Causes serious eye damage | Acros Organics |
| P phrase | P301 + P310: IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician | Acros Organics |
| P phrase | P301 + P310: IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician; P280: Wear protective gloves/protective clothing/eye protection/face protection; P312: Call a POISON CENTER or doctor/physician if you feel unwell; P302 + P350: IF ON SKIN: G | Acros Organics |
| R phrase | R23/24/25: Toxic by inhalation, in contact with skin and if swallowed. | Acros Organics |
| R phrase | R23/24/25: Toxic by inhalation, in contact with skin and if swallowed.; R41: Risk of serious damage to eyes. | 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.; S28A: After contact with skin, wash immediately with plenty of water.; S36/37/39: Wear suitable protective clothing, gloves and eye/face protection.; S38: | Acros Organics |
| Hazard | T: Toxic | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.