| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 14 | Yes |
Popular Name: 3-amino-3-(3,4-dichlorophenyl)propanoic acid 3-amino-3-(3,4-dichlorophenyl)pr…
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CAS Numbers: 117391-57-8 , 909709-43-9 , [117391-57-8]
3-(3,4-DICHLORO-PHENYL)-DL-BETA-ALANINE
3-(3,4-dichlorophenyl)-beta-alanine
3-Amino-3-(3,4-dichloro-phenyl)-propionic acid
3-Amino-3-(3,4-dichlorophenyl)-propanoic 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) | 0.23 | 4.09 | -44.89 | 3 | 3 | 0 | 68 | 234.082 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| melting_point | 224 - 226 | KeyOrganics |
| MP | 224-226° | Matrix Scientific |
| Purity | 97% | Fluorochem |
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
