N,N-Dimethyl-2-naphthylamine - ≥98%(GC) , CAS No.2436-85-3

CAS: 2436-85-3 Cat. No.: N159174 Molecular Weight: 171.24

GRADE & PURITY ≥98%(GC)

Synonyms

58BY8U8B9G | N,N-dimethylnaphthalen-2-amine | 2-Naphthalenamine, N,N-dimethyl- | N,N-Dimethyl-beta-naphthylamine | AKOS024288024 | Dimethyl(2-naphthyl)amine | SCHEMBL372242 | MFCD00059550 | EINECS 219-432-8 | IKZPRXHVTFNIEK-UHFFFAOYSA-N | 2-Dimethylaminon

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

58BY8U8B9G | N, N-dimethylnaphthalen-2-amine | 2-Naphthalenamine, N, N-dimethyl- | N, N-Dimethyl-beta-naphthylamine | AKOS024288024 | Dimethyl(2-naphthyl)amine | SCHEMBL372242 | MFCD00059550 | EINECS 219-432-8 | IKZPRXHVTFNIEK-UHFFFAOYSA-N | 2-Dimethylaminon

Specifications & Purity

≥98%(GC)

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%(GC)

Names and Identifiers

• Pubchem Sid: 504754958
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504754958
• Canonical Smiles: CN(C)C1=CC2=CC=CC=C2C=C1
• IUPAC Name: N,N-dimethylnaphthalen-2-amine
• InChIKey: IKZPRXHVTFNIEK-UHFFFAOYSA-N
• INCHI: 1S/C12H13N/c1-13(2)12-8-7-10-5-3-4-6-11(10)9-12/h3-9H,1-2H3
• Isomeric SMILES: CN(C)C1=CC2=CC=CC=C2C=C1
• Molecular Weight: 171.24
• Reaxy-Rn: 2206402
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2206402&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: Dialkylarylamines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Tertiary amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - 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

Chemical and Physical Properties

• Solubility: Soluble in Methanol
• Sensitivity: air sensitive
• Boil Point(°C): 305°C(lit.)
• Melt Point(°C): 45-47°C
• Molecular Weight: 171.240 g/mol
• XLogP3: 3.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 171.105 Da
• Monoisotopic Mass: 171.105 Da
• Topological Polar Surface Area: 3.200 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 165.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• 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