1-Amino-2-methylnaphthalene - ≥97% , CAS No.2246-44-8

CAS: 2246-44-8 Cat. No.: A111244 Molecular Weight: 157.21 Beilstein Registry Number: 2042530 EC Number: 629-014-0

GRADE & PURITY ≥97%

Synonyms

AKOS006221190 | FT-0634164 | C11H11N | DTXSID40176995 | 2-Methyl-1-naphthylamine, >=98.0% (GC) | 5P-039 | SCHEMBL157730 | 2-Methyl-1-naftylamin [Czech] | A0917 | J-014726 | Q27291048 | 1-Amino-2-methylnaphthalene | 2-Methyl-1-naphthalenamine | D81911 | 3-

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

AKOS006221190 | FT-0634164 | C11H11N | DTXSID40176995 | 2-Methyl-1-naphthylamine, >=98.0% (GC) | 5P-039 | SCHEMBL157730 | 2-Methyl-1-naftylamin [Czech] | A0917 | J-014726 | Q27291048 | 1-Amino-2-methylnaphthalene | 2-Methyl-1-naphthalenamine | D81911 | 3-

Specifications & Purity

≥97%

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

≥97%

Names and Identifiers

• Pubchem Sid: 488182290
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488182290
• Canonical Smiles: CC1=C(C2=CC=CC=C2C=C1)N
• IUPAC Name: 2-methylnaphthalen-1-amine
• InChIKey: JMBLSGAXSMOKPN-UHFFFAOYSA-N
• INCHI: 1S/C11H11N/c1-8-6-7-9-4-2-3-5-10(9)11(8)12/h2-7H,12H2,1H3
• Isomeric SMILES: CC1=C(C2=CC=CC=C2C=C1)N
• WGK Germany: 3
• RTECS: QM3675000
• Molecular Weight: 157.21
• Beilstein: 2042530
• Reaxy-Rn: 2042530
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2042530&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: Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - 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: light & air & heat sensitive
• Freezing Point(°C): 28 °C
• Refractive Index: 1.67
• Melt Point(°C): 28-31°C
• Molecular Weight: 157.210 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 157.089 Da
• Monoisotopic Mass: 157.089 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 155.000
• 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