N-Methyl-1-naphthylmethylamine - ≥98% , CAS No.14489-75-9

CAS: 14489-75-9 Cat. No.: N119591 Molecular Weight: 171.24 Beilstein Registry Number: 12(2)740 EC Number: 238-497-3

GRADE & PURITY ≥98%

Synonyms

4-(Benzyloxy)pyridine N-oxide, 97% | N-METHYL-1-NAPHTHALENMETHYLAMINE | W-108146 | EINECS 238-497-3 | Ethyl4-(methylamino)-2-(methylsulfanyl)-5-pyrimidinecarboxylate | FT-0672629 | Q27276647 | 1-Naphthalenemethanamine, N-methyl- | N-Methyl-(1-naphthylmeth

Storage

Protected from light,Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

4-(Benzyloxy)pyridine N-oxide, 97% | N-METHYL-1-NAPHTHALENMETHYLAMINE | W-108146 | EINECS 238-497-3 | Ethyl4-(methylamino)-2-(methylsulfanyl)-5-pyrimidinecarboxylate | FT-0672629 | Q27276647 | 1-Naphthalenemethanamine, N-methyl- | N-Methyl-(1-naphthylmeth

Specifications & Purity

≥98%

Storage

Protected from light, Argon charged, Room temperature

Shipped In

Normal

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 488186250
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186250
• Canonical Smiles: CNCC1=CC=CC2=CC=CC=C21
• IUPAC Name: N-methyl-1-naphthalen-1-ylmethanamine
• InChIKey: MQRIUFVBEVFILS-UHFFFAOYSA-N
• INCHI: 1S/C12H13N/c1-13-9-11-7-4-6-10-5-2-3-8-12(10)11/h2-8,13H,9H2,1H3
• Isomeric SMILES: CNCC1=CC=CC2=CC=CC=C21
• Alternate CAS: 14489-75-9
• NSC Number: 129392
• Molecular Weight: 171.24
• Beilstein: 12(2)740
• Reaxy-Rn: 2358309
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2358309&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 Dialkylamines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Aralkylamine - Secondary amine - Secondary aliphatic 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

• Sensitivity: Air sensitive;Light sensitive
• Refractive Index: 1.6160 to 1.6190
• Boil Point(°C): 90°C/0.6mmHg
• Molecular Weight: 171.240 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 171.105 Da
• Monoisotopic Mass: 171.105 Da
• Topological Polar Surface Area: 12.000 Ų
• Heavy Atom Count: 13
• 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

References

1. Yilun Sheng, Zhongnan Huang, Qi Zhong, Haohua Deng, Mingchun Lai, Yu Yang, Wei Chen, Xinghua Xia, Huaping Peng.  (2021)  Size-focusing results in highly photoluminescent sulfur quantum dots with a stable emission wavelength.  Nanoscale,  13  (4): (2519-2526).  [PMID:33475113] [10.1039/D0NR07251F]