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HCID 268472Erstellt: 27. Oktober 2026

1-[(Tert-butoxy)carbonyl]pyrrolidine-2-carboxylic acid

N-BOC-DL-PROLINE · 1-(TERT-BUTOXYCARBONYL)PYRROLIDINE-2-CARBOXYLIC ACID · NSC 108689 · AKOS 91525 · Boc-DL-Pro · Boc-DL-Pro-OH · BOC-DL-PROLINE · N-Boc-DL-proline,98%

https://huagongshe.com/de/chemical/268472

Molekülstruktur von 1-[(Tert-butoxy)carbonyl]pyrrolidine-2-carboxylic acid

Identifikatoren & physikalische Daten

CAS No.15761-39-4
SummenformelC10H17NO4
Durchschnittliche Molmasse215,25 g/mol
SMILESCC(C)(C)OC(=O)N1CCCC1C(=O)O
InChIKeyZQEBQGAAWMOMAI-UHFFFAOYSA-N
PubChem CID268472
ChEMBLCHEMBL1702785
EC No.854-296-9

Chemische & physikalische Eigenschaften

XLogP1,5
Polarare Oberfläche (TPSA)66,8
H-Brücken-Donoren1
H-Brücken-Akzeptoren4
Frei drehbare Bindungen3
Schwere Atome15
Formalladung0
Komplexität269
Schmelzpunkt133-135°C
Siedepunkt337.2±35.0 °C(Predicted)
Dichte1.201±0.06 g/cm3(Predicted)
Lagerbedingungen2-8°C
pKa (Säurekonstante)4.01±0.20(Predicted)
InChIInChI=1S/C10H17NO4/c1-10(2,3)15-9(14)11-6-4-5-7(11)8(12)13/h7H,4-6H2,1-3H3,(H,12,13)
InChIKeyZQEBQGAAWMOMAI-UHFFFAOYSA-N
SMILESN1(C(OC(C)(C)C)=O)CCCC1C(O)=O
CAS Datenbank59433-50-0(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-EinstufungWarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
GefahrenklasseIRRITANT