2-Methylbenzylamine - ≥98%(GC) , CAS No.89-93-0

CAS: 89-93-0 Cat. No.: M158667 Formula: C₈H₁₁N Peso molecolare: 121.18 Beilstein Registry Number: 12(3)2460 Numero EC: 201-952-1

GRADE & PURITY ≥98%(GC)

Synonyms

2-methylbenzyl amine | FS-4070 | DTXSID3059000 | AP-770/40653937 | (2-Methylphenyl)methanamine # | 2-methylbenzenemethanamine | HMS1719E19 | o-Xylylamine | (2-Methylphenyl)methanamine | EINECS 201-952-1 | NSC 30466 | 2-tolylmethylamine | BENZYLAMINE, o-ME

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Panoramica

2-Methylbenzylamine (o-Methylbenzylamine) was used in the preparation of boc-2-alkylanilines: N- (tert-butoxycarbonyl)-1-methylbenzylamine.

Specifications

Sinonimi

2-methylbenzyl amine | FS-4070 | DTXSID3059000 | AP-770/40653937 | (2-Methylphenyl)methanamine # | 2-methylbenzenemethanamine | HMS1719E19 | o-Xylylamine | (2-Methylphenyl)methanamine | EINECS 201-952-1 | NSC 30466 | 2-tolylmethylamine | BENZYLAMINE, o-ME

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥98%(GC)

Nomi e identificatori

• Pubchem Sid: 508808455
• Sorrisi canonici: CC1=CC=CC=C1CN
• IUPAC Name: (2-methylphenyl)methanamine
• InChIKey: CJAAPVQEZPAQNI-UHFFFAOYSA-N
• INCHI: 1S/C8H11N/c1-7-4-2-3-5-8(7)6-9/h2-5H,6,9H2,1H3
• Isomeri SMILES: CC1=CC=CC=C1CN
• WGK Germania: 3
• RTECS: DP5800000
• Peso molecolare: 121.18
• Beilstein: 12(3)2460
• Reaxy-Rn: 1099406
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1099406&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Phenylmethylamines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Phenylmethylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylmethylamines
• Alternative Parents: Benzylamines Toluenes Aralkylamines Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylmethylamine - Benzylamine - Aralkylamine - Toluene - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
• 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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: Air Sensitive
• Indice di rifrazione: 1.54
• Punto di infiammabilità (°F): 183.2 °F
• Punto di infiammabilità (°C): 84 °C
• Punto di ebollizione (°C): 82 °C/15 mmHg
• Peso molecolare: 121.180 g/mol
• XLogP3: 1.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 121.089 Da
• Monoisotopic Mass: 121.089 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 80.600
• 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

Riferimenti

1. Jun Dai, Juan Yang, Xiaohan Wang, Lei Zhang, Yingjie Li.  (2015)  Enhanced visible-light photocatalytic activity for selective oxidation of amines into imines over TiO2(B)/anatase mixed-phase nanowires.  APPLIED SURFACE SCIENCE,      [PMID:] [10.1016/j.apsusc.2015.04.232]