| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 17 | No |
Popular Name: 2-tert-Butoxycarbonylaminomalonic acid monoethyl ester 2-tert-Butoxycarbonylaminomaloni…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 137401-45-7 , 219308-59-5 , [137401-45-7] , [219308-59-5]
2-((tert-Butoxycarbonyl)amino)-3-ethoxy-3-oxopropanoic acid
2-(tert-butoxycarbonylamino)-3-ethoxy-3-oxopropanoic acid
2-tert-Butoxycarbonylaminomalonicacid monoethyl ester
2-tert-butoxycarbonylaminomalonicacidmonoethylester
2-{[(tert-butoxy)carbonyl]amino}-3-ethoxy-3-oxopropanoic acid
BUTOXYCARBONYLAMINOMALONICACIDMONOETHYLESTE
Sodium 2-((tert-butoxycarbonyl)amino)-3-ethoxy-3-oxopropanoate
| 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) | 0.95 | 3.26 | -48.37 | 1 | 7 | -1 | 105 | 246.239 | 7 | ↓ |
| Hi High (pH 8-9.5) | -4.43 | -9.42 | -51.71 | 7 | 12 | -1 | 209 | 365.315 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 86 - 88 | Enamine Building Blocks |
| MP | 86...88 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
