In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 7th, 2004 | 12 | Yes |
Popular Name: 2-Methyl-2-phenylpropanoic acid 2-Methyl-2-phenylpropanoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 826-55-1 , [826-55-1]
2-Methyl-2-phenylpropionic acid
2-Methyl-2-PhenylpropionicAcid
alpha,alpha-Dimethylphenylacetic 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) | 2.33 | 1.68 | -48.47 | 0 | 2 | -1 | 40 | 163.196 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Boiling_Point | 146.5? | Alfa-Aesar |
Boiling_Point | 146.5° | Alfa-Aesar |
MP | 190 - 192 | Enamine Building Blocks |
MP | 190...192 | Enamine Building Blocks |
MP | 76-79° | Oakwood Chemical |
mp | 79 | MolMall (formerly Molecular Diversity Preservation International) |
Melting_Point | 80-82? | Alfa-Aesar |
Melting_Point | 80-82° | Alfa-Aesar |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Purity | 95+% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |