| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2004 | 9 | Yes |
Popular Name: 2-chloro-5-methylaniline 2-chloro-5-methylaniline
(2-chloro-5-methylphenyl)amine
2-chloro-5-methyl-aniline hydrochloride
2-chloro-5-methylaniline hydrochloride
3-Amino-4-Chlorobenzotrifluoride [121-50-6]; (2-Chloro-5-(trifluoromethyl)aniline)
3-Amino-4-choloro-benzenesulfonic acid; (2-CHLOROANILINE-5-SULFONIC ACID)
| 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) | 2.48 | -0.54 | -2.61 | 2 | 1 | 0 | 26 | 141.601 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Boiling_Point | 228-230? | Alfa-Aesar |
| Boiling_Point | 228-230° | Alfa-Aesar |
| MP | 29 - 30 | Enamine Building Blocks |
| MP | 29-30° | Matrix Scientific |
| MP | 29...30 | Enamine Building Blocks |
| MP | 30-33° | Oakwood Chemical |
| Melting_Point | 31-33? | Alfa-Aesar |
| Melting_Point | 31-33° | Alfa-Aesar |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95+% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
| Warnings | Toxic | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.