1-Idrossiindano - ≥96% , CAS No.6351-10-6

CAS: 6351-10-6 Cat. No.: H419517 Formula: C₉H₁₀O Peso molecolare: 134.18 Beilstein Registry Number: 6574 Numero EC: 228-755-3

QUALITÀ & PUREZZA ≥96%

Synonyms

Indan-1-ol|1-Indanole|1H-Inden-1-ol,3-dihydro-|2,3-Dihydro-1H-inden-1-ol|(+/-)-1-Indanol|1-Hydroxyindan|(-)-indanol|(+/-)-1-Hydroxyindan|1H-Indenol, 2,3-dihydro-|1-Hydroxyindane|RASAGILINE METABOLITE, INDANOL|Indanol|1-Hydroxyhydrindene|1-INDANOL|Indan-1-ol (1-Indanol)

Storage

Conservare a 2-8°C

Shipped In

Ghiaccio umido

Panoramica

L'aggregazione chirale sensibile dell'1-indanolo è stata studiata mediante spettroscopia FTIR. La deidrogenazione di trasferimento dell'1-indanolo è stata studiata su un catalizzatore eterogeneo di palladio utilizzando il cicloesene come accettore di idrogeno.

Specifiche

Sinonimi

Indan-1-ol | 1-Indanole | 1H-Inden-1-ol,3-dihydro- | 2,3-Dihydro-1H-inden-1-ol | (+/-)-1-Indanol | 1-Hydroxyindan | (-)-indanol | (+/-)-1-Hydroxyindan | 1H-Indenol, 2,3-dihydro- | 1-Hydroxyindane | RASAGILINE METABOLITE, INDANOL | Indanol | 1-Hydroxyhydrindene | 1-INDANOL | Indan-1-ol (1-Indanol)

Specifiche e purezza

≥96%

Condizioni di conservazione di stoccaggio

Conservare a 2-8°C

Spedito in

Ghiaccio umido

Purezza

≥96%

Nomi e identificatori

Pubchem Sid

504753101

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504753101

Sorrisi canonici

C1CC2=CC=CC=C2C1O

IUPAC Name

2,3-dihydro-1H-inden-1-ol

InChIKey

YIAPLDFPUUJILH-UHFFFAOYSA-N

INCHI

1S/C9H10O/c10-9-6-5-7-3-1-2-4-8(7)9/h1-4,9-10H,5-6H2

Isomeri SMILES

C1CC2=CC=CC=C2C1O

RTECS

NK7300000

Peso molecolare

134.18

Beilstein

6574

Reaxy-Rn

2042960

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2042960&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: Secondary alcohols Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: Indane - Secondary alcohol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aromatic homopolycyclic compound
• Descrizione: 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: 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

Obiettivi associati (non umani)

Pseudomonas aeruginosa (123386 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Soluble in water 10 g/L at 20°C, ethanol, benzene.
• Punto di ebollizione (°C): 220 °C
• Punto di fusione (°C): 52 °C
• Peso molecolare: 134.170 g/mol
• XLogP3: 1.500
• 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: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1