5-Hydroxyindan - ≥99%(GC) , CAS No.1470-94-6

CAS: 1470-94-6 Cat. No.: H157229 Formule: C₉H₁₀O Poids moléculaire: 134.18 Numéro CE: 216-006-3

GRADE & PURITY ≥99%(GC)

Synonyms

5-Hydroxyhydrindene | 5-Indanol

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonymes

5-Hydroxyhydrindene | 5-Indanol

Spécifications et pureté

≥99%(GC)

Conditions de stockage de stockage

Argon charged,Room temperature

Expédié en

Normal

Pureté

≥99%(GC)

Noms et identifiants

• Pubchem Sid: 488182072
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488182072
• Sourires canoniques: C1CC2=C(C1)C=C(C=C2)O
• IUPAC Name: 2,3-dihydro-1H-inden-5-ol
• InChIKey: PEHSSTUGJUBZBI-UHFFFAOYSA-N
• INCHI: 1S/C9H10O/c10-9-5-4-7-2-1-3-8(7)6-9/h4-6,10H,1-3H2
• Isomères SMILES: C1CC2=C(C1)C=C(C=C2)O
• WGK Allemagne: 3
• RTECS: NK7525000
• Poids moléculaire: 134.18
• Reaxy-Rn: 1936314
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1936314&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Indanes

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Indanes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Indanes
• Alternative Parents: 1-hydroxy-2-unsubstituted benzenoids Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Indane - 1-hydroxy-2-unsubstituted benzenoid - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
• Description: This compound belongs to the class of organic compounds known as indanes. These are compounds containing an indane moiety, which consists of a cyclopentane fused to a benzene ring.
• External Descriptors: phenols - indanes

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

Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Solubility in water: Practically Insoluble; Degree of Solubility in water: 6,300 mg/l 25 °C; Soluble in Methanol
• Sensibilité: Air sensitive
• Point d'éclair (°F): 230 °F
• Point d'éclair (°C): 110 °C
• Point d'ébullition (°C): 255 °C
• Point de fusion (°C): 53 °C
• Poids moléculaire: 134.170 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 134.073 Da
• Monoisotopic Mass: 134.073 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 122.000
• 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

Foire aux questions

What is the purity of this product, and how is it determined?

This product is supplied at ≥99% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 1470-94-6, the molecular formula is C9H10O, and the molecular weight is 134.18 g/mol. InChIKey PEHSSTUGJUBZBI-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.