(−)-Bis[(S)-1-phenylethyl]amine - ≥99% , CAS No.56210-72-1

CAS: 56210-72-1 Cat. No.: B474342 Formule: [C₆H₅CH(CH₃)]₂NH Poids moléculaire: 225.33 Numéro CE: 611-365-6

GRADE & PURITY ≥99%

Synonyms

AKOS015915735 | 5D97T2Y7WU | NSC 1902 | AC1176 | Bis((S)-1-phenylethyl)amine | bis[(s)-1-phenylethyl]amine | DTXSID40200628 | (-)-Bis[(S)-1-phenylethyl]amine | UNII-5D97T2Y7WU | A-Methyl-N-[(1S)-1-phenylethyl]benzenemethanamine | ( | [S-(R*,R*)]-(-)-Bis(a

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Vue d’ensemble

Description

(−)-Bis[(S)-1-phenylethyl]amine can be used as:A key intermediate in the synthesis of phosphoramidite (Feringa) ligands.A reactant in the preparation of C(18)-C(24) unit of a novel macrolide compound lasonolide A.A starting material in the synthesis of tacrine−huperzine A hybrid.

Specifications

Synonymes

AKOS015915735 | 5D97T2Y7WU | NSC 1902 | AC1176 | Bis((S)-1-phenylethyl)amine | bis[(s)-1-phenylethyl]amine | DTXSID40200628 | (-)-Bis[(S)-1-phenylethyl]amine | UNII-5D97T2Y7WU | A-Methyl-N-[(1S)-1-phenylethyl]benzenemethanamine | ( | [S-(R*,R*)]-(-)-Bis(a

Spécifications et pureté

≥99%

Conditions de stockage de stockage

Store at 2-8°C,Argon charged

Expédié en

Wet ice

Ce produit nécessite l'expédition en chaîne froide. Les services terrestres et autres services économiques ne sont pas disponibles.

Pureté

≥99%

Noms et identifiants

Pubchem Sid

504764460

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504764460

Sourires canoniques

CC(C1=CC=CC=C1)NC(C)C2=CC=CC=C2

IUPAC Name

(1S)-1-phenyl-N-[(1S)-1-phenylethyl]ethanamine

InChIKey

NXLACVVNHYIYJN-KBPBESRZSA-N

INCHI

1S/C16H19N/c1-13(15-9-5-3-6-10-15)17-14(2)16-11-7-4-8-12-16/h3-14,17H,1-2H3/t13-,14-/m0/s1

Isomères SMILES

C[C@@H](C1=CC=CC=C1)N[C@@H](C)C2=CC=CC=C2

WGK Allemagne

3

Poids moléculaire

225.33

Reaxy-Rn

2213994

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2213994&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Amines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aralkylamines
• Alternative Parents: Benzene and substituted derivatives Dialkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aralkylamine - Benzenoid - Monocyclic benzene moiety - Secondary amine - Secondary aliphatic amine - Hydrocarbon derivative - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propriétés chimiques et physiques

• Solubilité: Immiscible with water.
• Sensibilité: Air Sensitive
• Indice de réfraction: n20/D 1.5525 (lit.)
• Rotation spécifique [α]: [α]/D −159°, c = 2 in ethanol
• Point d'éclair (°F): >235.4 °F
• Point d'éclair (°C): >113 °C
• Point d'ébullition (°C): 86 °C/0.05 mmHg (lit.)
• Poids moléculaire: 225.330 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 225.152 Da
• Monoisotopic Mass: 225.152 Da
• Topological Polar Surface Area: 12.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 180.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Foire aux questions

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 56210-72-1, the molecular formula is [C6H5CH(CH3)]2NH, and the molecular weight is 225.33 g/mol. InChIKey NXLACVVNHYIYJN-KBPBESRZSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.