In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2005 | 16 | Yes |
Popular Name: 3-{[(tert-butoxy)carbonyl]amino}cyclopentane-1-carboxylic acid 3-{[(tert-butoxy)carbonyl]amino}…
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CAS Numbers: 161660-94-2 , 261165-05-3 , 489446-85-7 , 855863-93-3
(+)-(1S,3R)-N-Boc-3-aminocyclopentanecarboxylicacid
(-)-(1R,3S)-N-Boc-3-aminocyclopentanecarboxylicacid
(1R,3R)-3-((tert-Butoxycarbonyl)amino)cyclopentanecarboxylic acid
(1R,3R)-N-BOC-1-Aminocyclopentane-3-carboxylic acid, 95%, 98% ee
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) | 3.21 | -0.76 | -47.08 | 1 | 5 | -1 | 78 | 228.268 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Mp [°C] | 117.3 | Acros Organics |
MP | 124 - 126 | Enamine Building Blocks |
MP | 124...126 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |