427470

(S)-(−)-N-Benzyl-α-methylbenzylamine

99%

• Synonym(s): (S)-(−)-N-(1-Phenylethyl)benzylamine, (S)-(−)-N-Benzyl-α-phenylethylamine
• Linear Formula: C₆H₅CH(CH₃)NHCH₂C₆H₅
• CAS Number: 17480-69-2
• Molecular Weight: 211.30
• Beilstein/REAXYS Number: 3650264
• MDL number: MFCD00066325
• UNSPSC Code: 12352116
• PubChem Substance ID: 24866762
• NACRES: NA.22

Properties

• assay: 99%
• form: liquid
• optical activity: [α]19/D −40°, neat
• optical purity: ee: ≥97% (HPLC)
• refractive index: n20/D 1.563 (lit.)
• bp: 171 °C/15 mmHg (lit.)
• density: 1.01 g/mL at 25 °C (lit.)
• SMILES string: C[C@H](NCc1ccccc1)c2ccccc2
• InChI: 1S/C15H17N/c1-13(15-10-6-3-7-11-15)16-12-14-8-4-2-5-9-14/h2-11,13,16H,12H2,1H3/t13-/m0/s1
• InChI key: ZYZHMSJNPCYUTB-ZDUSSCGKSA-N

Description

Application

(S)-(−)-N-Benzyl-α-methylbenzylamine can be used:

• In one of the key synthetic steps for the preparation of a cardioprotective drug named CP-060S.
• To prepare (1S,2S,3S,5R)-tert-butyl 3-[benzyl((S)-1-phenylethyl)amino]-6,6-dimethylbicyclo[3.1.1]heptane-2-carboxylate, an intermediate used to synthesize pinane-based β- and γ-amino acids.
• To prepare urea derivatives as potent antimicrobial agents.

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H302,H315,H319,H335
• pcodes: P261 - P264 - P270 - P301 + P312 - P302 + P352 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Oral - 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: 235.4 °F - closed cup
• flash_point_c: 113 °C - closed cup
• ppe: Eyeshields, Gloves, type ABEK (EN14387) respirator filter