Methylcyclopentane - ≥96% , CAS No.96-37-7

CAS: 96-37-7 Cat. No.: M101587 Fórmula: CH₃CH(CH₂)₄ Peso molecular: 84.16 Beilstein Registry Number: 1900214 Número CE: 202-503-2

GRAU & PUREZA ≥96%

Synonyms

WLN: L5TJ A1 | NSC 24836 | NCGC00260428-01 | UNII-5G26CC1ASK | NSC24836 | NSC-24836 | BRN 1900214 | InChI=1/C6H12/c1-6-4-2-3-5-6/h6H,2-5H2,1H | CCRIS 6058 | FT-0629521 | EINECS 202-503-2 | Methylcyclopentane [UN2298] [Flammable liquid] | Cyclopentane, me

Storage

Room temperature

Shipped In

FedEx DG Service

Visão geral

Methylcyclopentane can undergo ring opening or ring enlargement to yield various hydrocarbons including branched and unbranched hexanes, cyclohexane and benzene.

Especificações

Sinónimos

WLN: L5TJ A1 | NSC 24836 | NCGC00260428-01 | UNII-5G26CC1ASK | NSC24836 | NSC-24836 | BRN 1900214 | InChI=1/C6H12/c1-6-4-2-3-5-6/h6H,2-5H2,1H | CCRIS 6058 | FT-0629521 | EINECS 202-503-2 | Methylcyclopentane [UN2298] [Flammable liquid] | Cyclopentane, me

Especificações e pureza

≥96%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

FedEx DG Service

Pureza

≥96%

Nomes e identificadores

Pubchem Sid

504751295

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504751295

Sorrisos canónicos

CC1CCCC1

IUPAC Name

methylcyclopentane

InChIKey

GDOPTJXRTPNYNR-UHFFFAOYSA-N

INCHI

1S/C6H12/c1-6-4-2-3-5-6/h6H,2-5H2,1H3

SMILES isoméricas

CC1CCCC1

WGK Alemanha

3

RTECS

GY4640000

Número UN

2298

Grupo de embalagem

II

Peso molecular

84.16

Beilstein

1900214

Reaxy-Rn

1900214

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1900214&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • Classe Saturated hydrocarbons
      • Subclass Cycloalkanes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Classe: Saturated hydrocarbons
• Subclass: Cycloalkanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Cycloalkanes
• Alternative Parents: Not available
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cycloalkane - Aliphatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as cycloalkanes. These are saturated monocyclic hydrocarbons (with or without side chains).
• 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

Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Insoluble in water; Degree of Solubility in water: 42 mg/l 25 °C; Miscible with Ether,Acetone,Ethanol
• Ponto de congelamento (°C): -140 °C
• Índice de refração: 1.41
• Ponto de inflamação (°F): -20.2℉
• Ponto de inflamação (°C): -29°C
• Ponto de ebulição (°C): 72°C
• Ponto de fusão (°C): -140 °C
• Peso molecular: 84.160 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 84.0939 Da
• Monoisotopic Mass: 84.0939 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 33.300
• 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