| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2005 | 10 | Yes |
Popular Name: 3,5-dichlorobenzylamine 3,5-dichlorobenzylamine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 10541-69-2 , 39989-43-0 , [39989-43-0]
| 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) | 2.41 | -2.14 | -48.65 | 3 | 1 | 1 | 27 | 177.054 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.90 | 2.27 | -102.81 | 7 | 10 | 1 | 161 | 500.58 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP [°C] | 116 (p=10 torr) | Acros Organics |
| Boiling_Point | 141-144?/15mm | Alfa-Aesar |
| Boiling_Point | 141-144°/15mm | Alfa-Aesar |
| Purity | 97% | Fluorochem |
| Hazard | C: Corrosive | Acros Organics |
| Warnings | CORROSIVE | Matrix Scientific |
| H phrase | H314: Causes severe skin burns and eye damage | Acros Organics |
| P phrase | P280: Wear protective gloves/protective clothing/eye protection/face protection; P303 + P361 + P353: IF ON SKIN (or hair): Take off immediately all contaminated clothing. Rinse skin with water/shower; P305 + P351 + P338: IF IN EYES: Rinse cautiously with | Acros Organics |
| P phrase | P301 + P330 + P331: IF SWALLOWED: rinse mouth. Do NOT induce vomiting | Acros Organics |
| R phrase | R34: Causes burns. | Acros Organics |
| S phrase | S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.