Heptano - ≥99%(GC) , CAS No.142-82-5

CAS: 142-82-5 Cat. No.: H108111 Fórmula: C₇H₁₆ Peso molecular: 100.2 Beilstein Registry Number: 1730763 Número CE: 205-563-8

GRAU & PUREZA ≥99%(GC)

Synonyms

DTXSID6024127 | HEPTANO | heptan-e | Heptano, Padrão Secundário Farmacêutico; Material de Referência Certificado | Heptano, para HPLC | normal-Heptano | H0491 | Heptano, puriss. p.a., Reag. Ph. Eur., >=99% base n-heptano (GC) | Heptano, AR, >=99% | Q31095

Storage

Carregado com árgon

Shipped In

FedEx DG Service

Especificações

Sinónimos

DTXSID6024127 | HEPTANO | heptan-e | Heptano, Padrão Secundário Farmacêutico; Material de Referência Certificado | Heptano, para HPLC | normal-Heptano | H0491 | Heptano, puriss. p.a., Reag. Ph. Eur., >=99% base n-heptano (GC) | Heptano, AR, >=99% | Q31095

Especificações e pureza

≥99%(GC)

Condições de armazenamento de armazenamento

Carregado com árgon

Enviado em

FedEx DG Service

Pureza

≥99%(GC)

Nomes e identificadores

Pubchem Sid

508813821

Sorrisos canónicos

CCCCCCC

IUPAC Name

heptane

InChIKey

IMNFDUFMRHMDMM-UHFFFAOYSA-N

INCHI

1S/C7H16/c1-3-5-7-6-4-2/h3-7H2,1-2H3

SMILES isoméricas

CCCCCCC

WGK Alemanha

2

RTECS

MI7700000

Número UN

1206

Grupo de embalagem

II

Peso molecular

100.2

Beilstein

1730763

Reaxy-Rn

1730763

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1730763&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• Classe: Saturated hydrocarbons
• Subclass: Alkanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkanes
• Alternative Parents: Not available
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyclic alkane - Alkane - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as alkanes. These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2 , and therefore consisting entirely of hydrogen atoms and saturated carbon atoms.
• 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

Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Insoluble in water; Degree of Solubility in water: 2.93 mg/l 25 °C; Soluble in Ether,Chloroform,Alcohol
• Índice de refração: 1.3855
• Ponto de inflamação (°F): 71.6 °F
• Ponto de inflamação (°C): (closed cup)-4℃
• Ponto de ebulição (°C): 98.4°C
• Ponto de fusão (°C): -90.7°C
• Peso molecular: 100.200 g/mol
• XLogP3: 4.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 4
• Exact Mass: 100.125 Da
• Monoisotopic Mass: 100.125 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 19.200
• 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