| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2009 | 10 | Yes |
Popular Name: H-Asp-OMe H-Asp-OMe
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17812-32-7 , 65414-77-9 , [17812-32-7]
(3S)-3-amino-4-methoxy-4-oxobutanoic acid
(S)-3-amino-4-methoxy-4-oxobutanoic acid
(S)-3-Amino-4-methoxy-4-oxobutyric acid
3-Amino-4-methoxy-4-oxobutanoic acid
L-Aspartic acid 1-methyl ester, 98%
L-ASPARTIC ACID b-METHYLESTER HYDROCHLORIDE; [16856-13-6]
L-Aspartic Acid Methylester Hydrochloride [16856-13-6]; (H-Asp-(OMe)-OH HCl)
| 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) | -1.45 | 0.74 | -38.82 | 2 | 5 | -1 | 92 | 146.122 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 186 | TCI |
| Melting_Point | 186? dec | Alfa-Aesar |
| MP | 191-193°C | Indofine |
| Purity | 95% | Fluorochem |
| Purity | 98% min | APIChem |
| PUBCHEM_PATENT_ID | WO1995003793A1 | IBM Patent Data |
| PUBCHEM_PATENT_ID | WO2000071572A1 | IBM Patent Data |
