DL-1-(1-Naphthyl)ethylamine - ≥97%(GC) , CAS No.42882-31-5

CAS: 42882-31-5 Cat. No.: S161209 Molecular Weight: 171.24 Beilstein Registry Number: 3197380 EC Number: 610-076-2

GRADE & PURITY ≥97%(GC)

Synonyms

AKOS000121452 | (R)-alpha-Methyl-1-naphthalenemethanamine | AI3-26857 | SB36972 | N-BENZYLOXYCARBONYL-4-PIPERIDINESULFONYLCHLORIDE | 1-(1-Naphthyl)ethylamine, 98% | PB48766 | SCHEMBL1906169 | 1-(naphthalen-1-yl)ethanamine | MFCD00064114 | NSC 75881 | (3-H

Storage

Argon charged,Room temperature

Shipped In

Normal

Overview

The adsorption of 1-(1-naphthyl)ethylamine on platinum surfaces has been characterized by reflection-absorption infrared spectroscopy and temperature-programmed desorption both under ultrahigh vacuum and in situ from liquid solutions

Specifications

Synonyms

AKOS000121452 | (R)-alpha-Methyl-1-naphthalenemethanamine | AI3-26857 | SB36972 | N-BENZYLOXYCARBONYL-4-PIPERIDINESULFONYLCHLORIDE | 1-(1-Naphthyl)ethylamine, 98% | PB48766 | SCHEMBL1906169 | 1-(naphthalen-1-yl)ethanamine | MFCD00064114 | NSC 75881 | (3-H

Specifications & Purity

≥97%(GC)

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥97%(GC)

Names and Identifiers

• Pubchem Sid: 488187105
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488187105
• Canonical Smiles: CC(C1=CC=CC2=CC=CC=C21)N
• IUPAC Name: 1-naphthalen-1-ylethanamine
• InChIKey: RTCUCQWIICFPOD-UHFFFAOYSA-N
• INCHI: 1S/C12H13N/c1-9(13)11-8-4-6-10-5-2-3-7-12(10)11/h2-9H,13H2,1H3
• Isomeric SMILES: CC(C1=CC=CC2=CC=CC=C21)N
• WGK Germany: 3
• Molecular Weight: 171.24
• Beilstein: 3197380
• Reaxy-Rn: 2208023
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2208023&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Class Naphthalenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Class: Naphthalenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenes
• Alternative Parents: Aralkylamines Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Aralkylamine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as naphthalenes. These are compounds containing a naphthalene moiety, which consists of two fused benzene rings.
• 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

Mechanisms of Action

Chemical and Physical Properties

• Sensitivity: Moisture sensitive
• Refractive Index: 1.62
• Flash Point(°F): 235.4 °F
• Flash Point(°C): 113 °C
• Boil Point(°C): 142°C/5mmHg(lit.)
• Molecular Weight: 171.240 g/mol
• XLogP3: 2.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 171.105 Da
• Monoisotopic Mass: 171.105 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 167.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1