In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 9 | Yes |
Popular Name: 3-Fluoro-4-methylaniline 3-Fluoro-4-methylaniline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 452-77-7 , [452-77-7]
"3-Fluoro-4-methylaniline, 99%"
3-Fluoro-4-methylaniline, 98+%
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) | 1.55 | 3.08 | -3.72 | 2 | 1 | 0 | 26 | 125.146 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 30-32° | Matrix Scientific |
Melting_Point | 30-35? | Alfa-Aesar |
Melting_Point | 30-35° | Alfa-Aesar |
Boiling_Point | 93?/12mm | Alfa-Aesar |
Boiling_Point | 93°/12mm | Alfa-Aesar |
Purity | 99% | Matrix Scientific |
Warnings | IRRITANT, TOXIC | Matrix Scientific |
Warnings | Toxic/Irritant | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.