302112

N-Benzyl-L-prolinol

99%

• Synonym(s): (S)-(−)-1-Benzylpyrrolidine-2-methanol
• Empirical Formula (Hill Notation): C₁₂H₁₇NO
• CAS Number: 53912-80-4
• Molecular Weight: 191.27
• Beilstein/REAXYS Number: 3663640
• MDL number: MFCD00011728
• UNSPSC Code: 12352209
• PubChem Substance ID: 24858233
• NACRES: NA.22

Properties

• Quality Level: 100
• assay: 99%
• form: liquid
• optical activity: [α]20/D −72.7°, neat
• reaction suitability: reaction type: solution phase peptide synthesis
• refractive index: n20/D 1.541 (lit.)
• bp: 115-120 °C/0.5 mmHg (lit.)
• density: 1.08 g/mL at 25 °C (lit.)
• application(s): peptide synthesis
• SMILES string: OC[C@@H]1CCCN1Cc2ccccc2
• InChI: 1S/C12H17NO/c14-10-12-7-4-8-13(12)9-11-5-2-1-3-6-11/h1-3,5-6,12,14H,4,7-10H2/t12-/m0/s1
• InChI key: ZAIQBJPTOXDDKA-LBPRGKRZSA-N

Description

Application

Precursor in the synthesis of proline-derived homochiral amine oxides. Starting material for enantiomerically pure 3-hydroxypiperidine, a structural feature present in many natural products.

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H315,H319,H335
• pcodes: P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• target_organs: Respiratory system
• Storage Class: 10 - Combustible liquids
• wgk_germany: WGK 3
• flash_point_f: 230.0 °F - closed cup
• flash_point_c: 110 °C - closed cup
• ppe: Eyeshields, Gloves, type ABEK (EN14387) respirator filter