| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 12th, 2004 | 15 | Yes |
Popular Name: Boc-DL-Valine Boc-DL-Valine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 13734-41-3 , 141509-91-3 , 22838-58-0 , 54895-12-4 , [13734-41-3] , [54895-12-4]
(2S)-2-{[(tert-butoxy)carbonyl]amino}-3-methylbutanoic acid
(S)-2-((tert-Butoxycarbonyl)amino)-3-methylbutanoic acid
(S)-2-(Boc-amino)-3-methylbutyric acid
(S)-2-(BOC-AMINO)PENTANOIC ACID
2-((tert-Butoxycarbonyl)amino)-3-methylbutanoic acid
2-(Boc-amino)-3-methylbutyric acid
Boc-L-Valine [13734-41-3]; (Boc-Val-OH)
L-valine, N-[(1,1-dimethylethoxy)carbonyl]-
| 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) | 1.83 | 3.74 | -50.45 | 1 | 5 | -1 | 78 | 216.257 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 112 - 114 | Acros Organics |
| Melting_Point | 112-114? | Alfa-Aesar |
| Mp [°C] | 76 - 80 | Acros Organics |
| MP | 77-80 °C(lit.) | Indofine |
| Melting_Point | 77-80? | Alfa-Aesar |
| Melting_Point | 77-80° | Alfa-Aesar |
| MP | 78 | TCI |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 98% | Fluorochem |
| PUBCHEM_PATENT_ID | EP1054891A1; WO1999041275A1 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
| S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
