In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2005 | 11 | Yes |
Popular Name: 3,5-Difluorobenzoic acid 3,5-Difluorobenzoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 455-40-3 , 530141-39-0 , [530141-39-0]
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) | 2.10 | 2.26 | -41.85 | 0 | 2 | -1 | 40 | 157.095 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Melting_Point | 119-123? | Alfa-Aesar |
Melting_Point | 119-123° | Alfa-Aesar |
MP | 121 - 123 | Enamine Building Blocks |
MP | 121-123° | Matrix Scientific |
MP | 121...123 | Enamine Building Blocks |
MP | 122 | TCI |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Purity | 97% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |