| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2005 | 7 | No |
Popular Name: Sodium 2-bromoethanesulfonate Sodium 2-bromoethanesulfonate
Find On: PubMed — Wikipedia — Google
CAS Numbers: 179328-22-4 , 26978-65-4 , 4263-52-9 , [4263-52-9]
"2-Bromoethanesulfonic acid sodium salt, 98.5%"
2-Bromoethanesulfonic acid sodium salt
2-Bromoethanesulfonic acid, sodium salt
2-Bromoethanesulfonic acid, sodium salt, 98%
N-Methyl-4-(4-morpholinyl)benzylamine
sodium 2-bromoethane-1-sulfonate
| 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) | -1.87 | -6.66 | -37.9 | 0 | 3 | -1 | 57 | 188.022 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 282 - 286 | Acros Organics |
| MP | 283 - 285 | Enamine Building Blocks |
| MP | 283...285 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 97% | Fluorochem |
| Melting_Point | ca 284? dec. | Alfa-Aesar |
| Melting_Point | ca 284° dec. | Alfa-Aesar |
| H phrase | H315: Causes skin irritation | Acros Organics |
| H phrase | H315: Causes skin irritation; H319: Causes serious eye irritation; H335: May cause respiratory 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; P280: Wear protective gloves/protective clothing/eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water | 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 |
| 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.