In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 9 | Yes |
Popular Name: 3-Chloro-4-methylaniline 3-Chloro-4-methylaniline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 7745-89-3 , 827571-80-2 , 95-74-9 , [95-74-9]
"3-Chloro-4-methylaniline, 99%"
3-Chloro-4-methyl-phenylamine hydrochloride
3-Chloro-4-methylaniline hydrochloride
3-Chloro-4-methylaniline hydrochloride, 97%
4-Amino-2-Chlorobenzotrifluoride [445-13-6]; (3-Chloro-4-(trifluoromethyl)aniline)
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) | 2.07 | 3.47 | -2.95 | 2 | 1 | 0 | 26 | 141.601 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Melting_Point | 22-24? | Alfa-Aesar |
Melting_Point | 22-24° | Alfa-Aesar |
Boiling_Point | 236-238? | Alfa-Aesar |
Boiling_Point | 236-238° | Alfa-Aesar |
BP | 237-238° | Fluorochem |
MP | 24-25° | Fluorochem |
BP | 244 | TCI |
Purity | 98% | Fluorochem |
Melting_Point | ca 260? subl. | Alfa-Aesar |
Melting_Point | ca 260° subl. | Alfa-Aesar |
Patent Database Links | EP1422218; WO2006060381 | ChEBI |