4-Methyl-1-naphthaldehyde - ≥95% , CAS No.33738-48-6

CAS: 33738-48-6 Cat. No.: M300775 Summenformel: C₁₂H₁₀O Molekulargewicht: 170.21 EG-Nummer: 674-090-0

GRADE & PURITY ≥95%

Synonyms

DTXSID10187412 | 1-Methyl-4-naphthaldehyd | 1-Methylnaphthalene-4-carboxaldehyde | 4-Methyl-1-naphthaldehyde, 97% | SCHEMBL2184850 | 4-Methyl-1-naphthaldehyde | FS-4671 | Z57887836 | 4-methyl-2-morpholino-thiazole-5-carbaldehyde | 4-methyl-naphthalene-1-c

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyme

DTXSID10187412 | 1-Methyl-4-naphthaldehyd | 1-Methylnaphthalene-4-carboxaldehyde | 4-Methyl-1-naphthaldehyde, 97% | SCHEMBL2184850 | 4-Methyl-1-naphthaldehyde | FS-4671 | Z57887836 | 4-methyl-2-morpholino-thiazole-5-carbaldehyde | 4-methyl-naphthalene-1-c

Spezifikationen & Reinheit

≥95%

Storage

Store at 2-8°C,Argon charged

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

504757237

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504757237

Kanonisches Lächeln

CC1=CC=C(C2=CC=CC=C12)C=O

IUPAC Name

4-methylnaphthalene-1-carbaldehyde

InChIKey

LANRGTXVAPBSIA-UHFFFAOYSA-N

INCHI

1S/C12H10O/c1-9-6-7-10(8-13)12-5-3-2-4-11(9)12/h2-8H,1H3

Isomere SMILES

CC1=CC=C(C2=CC=CC=C12)C=O

Molekulargewicht

170.21

Reaxy-Rn

2043188

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2043188&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Naphthalenes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Naphthalenes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenes
• Alternative Parents: Aryl-aldehydes Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Naphthalene - Aryl-aldehyde - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aldehyde - Aromatic homopolycyclic compound
• Beschreibung: 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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Schmelzpunkt (°C): 31-33°
• Molekulargewicht: 170.210 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 170.073 Da
• Monoisotopic Mass: 170.073 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 188.000
• 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