In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2006 | 17 | Yes |
Popular Name: 4-(4-ethoxy-3-methylphenyl)-4-oxobutanoic acid 4-(4-ethoxy-3-methylphenyl)-4-ox…
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CAS Numbers: 150435-98-6 , [150435-98-6]
4-(4-Ethoxy-3-methyl-phenyl)-4-oxo-butyric acid
4-(4-Ethoxy-3-methyl-phenyl)-4-oxo-butyricacid
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) | 2.06 | 1.63 | -47.29 | 0 | 4 | -1 | 66 | 235.259 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Warnings | IRRITANT | Matrix Scientific |