2-[(Methylamino)methyl]pyridine - ≥97% , CAS No.21035-59-6

CAS: 21035-59-6 Cat. No.: M168526 Summenformel: C₇H₁₀N₂ Molekulargewicht: 122.17 EG-Nummer: 244-160-1

QUALITÄT & REINHEIT ≥97%

Synonyms

2-(2-METHYLAMINOMETHYL)PYRIDINE | Methyl(2-pyridylmethyl)amine | 2-Pyridinemethanamine, N-methyl- | 4-(4-DIMETHYLAMINO-PHENYL)-BUT-3-EN-2-ONE | NCIOpen2_000295 | NSC 63910 | 2-[METHYL(AMINOMETHYL)]PYRIDINE DIHYDROCHLORIDE | BBL029574 | SCHEMBL9058872 | N-

Storage

Room temperature

Shipped In

Normal

Spezifikationen

Synonyme

2-(2-METHYLAMINOMETHYL)PYRIDINE | Methyl(2-pyridylmethyl)amine | 2-Pyridinemethanamine, N-methyl- | 4-(4-DIMETHYLAMINO-PHENYL)-BUT-3-EN-2-ONE | NCIOpen2_000295 | NSC 63910 | 2-[METHYL(AMINOMETHYL)]PYRIDINE DIHYDROCHLORIDE | BBL029574 | SCHEMBL9058872 | N-

Spezifikationen & Reinheit

≥97%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥97%

Namen und Kennungen

Pubchem Sid

504755960

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504755960

Kanonisches Lächeln

CNCC1=CC=CC=N1

IUPAC Name

N-methyl-1-pyridin-2-ylmethanamine

InChIKey

OOTKJPZEEVPWCR-UHFFFAOYSA-N

INCHI

1S/C7H10N2/c1-8-6-7-4-2-3-5-9-7/h2-5,8H,6H2,1H3

Isomere SMILES

CNCC1=CC=CC=N1

WGK Deutschland

3

Molekulargewicht

122.17

Reaxy-Rn

2448

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2448&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Pyridines and derivatives
      • Subclass 2-pyridylmethylamines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Pyridines and derivatives
• Subclass: 2-pyridylmethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: 2-pyridylmethylamines
• Alternative Parents: Aralkylamines Heteroaromatic compounds Dialkylamines Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: 2-pyridylmethylamine - Aralkylamine - Heteroaromatic compound - Azacycle - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as 2-pyridylmethylamines. These are aromatic heterocyclic compounds contaning a pyridine ring which is substituted at the 2-position with a methylamine.
• 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

Chemische und physikalische Eigenschaften

• Empfindlichkeit: heat sensitive
• Brechungsindex: 1.524
• Flammpunkt (°F): 179.6 °F
• Flammpunkt (°C): 82 °C
• Molekulargewicht: 122.170 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 122.084 Da
• Monoisotopic Mass: 122.084 Da
• Topological Polar Surface Area: 24.900 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 73.300
• 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