| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2004 | 10 | Yes |
Popular Name: 4-Bromo-N,N-dimethylaniline 4-Bromo-N,N-dimethylaniline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 586-77-6 , [586-77-6]
"4-Bromo-N,N-dimethylaniline, 98%"
4-Bromo-N,N-dimethylaniline, 98+%
4-Bromo-N,N-dimethylaniline, 99%
| 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) | 2.85 | 0.31 | -2.85 | 0 | 1 | 0 | 3 | 200.079 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 263-265? | Alfa-Aesar |
| Boiling_Point | 263-265° | Alfa-Aesar |
| BP [°C] | 264 | Acros Organics |
| BP | 264° | Fluorochem |
| MP | 52 - 54 | Enamine Building Blocks |
| Melting_Point | 52-56? | Alfa-Aesar |
| Melting_Point | 52-56° | Alfa-Aesar |
| MP | 52...54 | Enamine Building Blocks |
| Mp [°C] | 53 - 56 | Acros Organics |
| MP | 54 | TCI |
| MP | 54 - 55 | Enamine Building Blocks |
| MP | 54-55° | Fluorochem |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95+% | Matrix Scientific |
| Purity | 98% | Matrix Scientific |
| Purity | 99% | Fluorochem |
| H phrase | H335: May cause respiratory irritation; H315: Causes skin irritation; H319: Causes serious eye irritation; H302: Harmful if swallowed; H312: Harmful in contact with skin; H332: Harmful if inhaled | Acros Organics |
| H phrase | H351: Suspected of causing cancer | Acros Organics |
| Warnings | IRRITANT | Matrix Scientific |
| P phrase | P281: Use personal protective equipment as required | Acros Organics |
| P phrase | P281: Use personal protective equipment as required; P301+ P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell; P302+ P352: IF ON SKIN: Wash with plenty of soap and water; P280: Wear protective gloves/protective clothing/eye pr | Acros Organics |
| R phrase | R20/21/22: Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38: Irritating to eyes, respiratory system and skin. | Acros Organics |
| R phrase | R22: Harmful if swallowed. | Acros Organics |
| S phrase | S28A: After contact with skin, wash immediately with plenty of water. | Acros Organics |
| Hazard | XN: Harmful | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.