cis-Hydrindane - ≥99%(GC) , CAS No.4551-51-3

CAS: 4551-51-3 Cat. No.: C153599 Summenformel: C₉H₁₆ Molekulargewicht: 124.23 EG-Nummer: 679-906-9

GRADE & PURITY ≥99%(GC)

Synonyms

cis-Hexahydroindan | 1H-INDENE, OCTAHYDRO-, (3AR,7AS)-REL- | cis-Hydrindan | H0504 | CHEBI:49306 | BNRNAKTVFSZAFA-DTORHVGOSA-N | Octahydro-1H-indene, cis | Octahydro-1H-indene, cis- | cis-Octahydro-1H-indene | BCP15250 | CIS-PERHYDROINDAN | MFCD00085357 |

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

cis-Hexahydroindan | 1H-INDENE, OCTAHYDRO-, (3AR,7AS)-REL- | cis-Hydrindan | H0504 | CHEBI:49306 | BNRNAKTVFSZAFA-DTORHVGOSA-N | Octahydro-1H-indene, cis | Octahydro-1H-indene, cis- | cis-Octahydro-1H-indene | BCP15250 | CIS-PERHYDROINDAN | MFCD00085357 |

Spezifikationen & Reinheit

≥99%(GC)

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥99%(GC)

Namen und Kennungen

• Kanonisches Lächeln: C1CCC2CCCC2C1
• IUPAC Name: (3aS,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-indene
• InChIKey: BNRNAKTVFSZAFA-DTORHVGOSA-N
• INCHI: 1S/C9H16/c1-2-5-9-7-3-6-8(9)4-1/h8-9H,1-7H2/t8-,9+
• Isomere SMILES: C1CC[C@H]2CCC[C@H]2C1
• Molekulargewicht: 124.23
• Reaxy-Rn: 2321743
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2321743&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Klasse Polycyclic hydrocarbons

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Klasse: Polycyclic hydrocarbons
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Polycyclic hydrocarbons
• Alternative Parents: Saturated hydrocarbons
• Molecular Framework: Aliphatic homopolycyclic compounds
• Substituents: Polycyclic hydrocarbon - Saturated hydrocarbon - Aliphatic homopolycyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as polycyclic hydrocarbons. These are polycyclic organic compounds made up only of carbon and hydrogen atoms.
• External Descriptors: hydrindane

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): 37 °C
• Siedepunkt (°C): 166°C
• Molekulargewicht: 124.220 g/mol
• XLogP3: 4.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 124.125 Da
• Monoisotopic Mass: 124.125 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 84.200
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 2
• 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

Häufig gestellte Fragen

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.

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 4551-51-3, the molecular formula is C9H16, and the molecular weight is 124.23 g/mol. InChIKey BNRNAKTVFSZAFA-DTORHVGOSA-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.