In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2014 | 0 | No |
Popular Name: Basic Orange 2 Basic Orange 2
Find On: PubMed — Wikipedia — Google
CAS Numbers: 495-54-5 , 532-82-1 , [532-82-1]
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) | 2.62 | 1.48 | -8.03 | 4 | 4 | 0 | 77 | 212.256 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Mp [°C] | 235 | Acros Organics |
H phrase | H315: Causes skin irritation | Acros Organics |
H phrase | H315: Causes skin irritation; H341: Suspected of causing genetic defects; H318: Causes serious eye damage; H302: Harmful if swallowed; H410: Very toxic to aquatic life with long lasting effects | Acros Organics |
P phrase | P280: Wear eye protection/face protection | Acros Organics |
P phrase | P280: Wear eye protection/face protection; P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing; P310: Immediately call a POISON CENTER or doctor/physician; P28 | Acros Organics |
R phrase | R22: Harmful if swallowed. | Acros Organics |
R phrase | R22: Harmful if swallowed.; R38: Irritating to skin.; R41: Risk of serious damage to eyes.; R50/53: Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.; R68: Possible risks of irreversible effects. | 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.; S36/37: Wear suitable protective clothing and gloves. | Acros Organics |
Hazard | XN: Harmful | Acros Organics |
Hazard | XN: Harmful; N: Dangerous for the environment | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.