2-Naphthol - BioReagenz, ≥99%(GC) , CAS No.135-19-3

CAS: 135-19-3 Cat. No.: N755556 Summenformel: C₁₀H₈O Molekulargewicht: 144.17 Beilstein Registry Number: 742134 EG-Nummer: 205-182-7

QUALITÄT & REINHEIT BioReagent, ≥99%(GC)

Storage

Raumtemperatur

Shipped In

Normal

Spezifikationen

Spezifikationen & Reinheit

BioReagenz, ≥99%(GC)

Storage

Raumtemperatur

Verschickt in

Normal

Note

BioReagent

Reinheit

≥99%(GC)

Namen und Kennungen

Pubchem Sid

528757664

Kanonisches Lächeln

C1=CC=C2C=C(C=CC2=C1)O

IUPAC Name

naphthalen-2-ol

InChIKey

JWAZRIHNYRIHIV-UHFFFAOYSA-N

INCHI

1S/C10H8O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H

Isomere SMILES

C1=CC=C2C=C(C=CC2=C1)O

WGK Deutschland

2

RTECS

QL2975000

UN-Nummer

2811

Molekulargewicht

144.17

Beilstein

742134

Reaxy-Rn

742134

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=742134&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Naphthalenes
      • Subclass Naphthols and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Naphthalenes
• Subclass: Naphthols and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthols and derivatives
• Alternative Parents: 1-hydroxy-2-unsubstituted benzenoids Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: 2-naphthol - 1-hydroxy-2-unsubstituted benzenoid - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as naphthols and derivatives. These are naphthalene derivatives carrying one or more hydroxyl (-OH) groups at any ring position.
• External Descriptors: a small molecule

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

• Flammpunkt (°C): 161℃
• Siedepunkt (°C): 285～286°C
• Schmelzpunkt (°C): 121-123°C
• Molekulargewicht: 144.170 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 144.058 Da
• Monoisotopic Mass: 144.058 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 133.000
• 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