Heptane - HPLC grade, ≥99%(GC) , CAS No.142-82-5

CAS: 142-82-5 Cat. No.: H108112 Formula: C₇H₁₆ Peso molecolare: 100.2 Beilstein Registry Number: 1730763 Numero EC: 205-563-8

QUALITÀ & PUREZZA HPLC grade, ≥99%(GC)

Synonyms

n-Heptane | Heptan

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Specifiche

Sinonimi

n-Heptane | Heptan

Specifiche e purezza

HPLC grade, ≥99%(GC)

Condizioni di conservazione di stoccaggio

Room temperature,Argon charged

Spedito in

FedEx DG Service

Grado

HPLC grade

Purezza

≥99%(GC)

Nomi e identificatori

Pubchem Sid

508813822

Sorrisi canonici

CCCCCCC

IUPAC Name

heptane

InChIKey

IMNFDUFMRHMDMM-UHFFFAOYSA-N

INCHI

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

Isomeri SMILES

CCCCCCC

WGK Germania

2

RTECS

MI7700000

Numero UN

1206

Gruppo di imballaggio

II

Peso molecolare

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
• Descrizione: 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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Insoluble in water; Degree of Solubility in water: 2.93 mg/l 25 °C; Soluble in Ether,Chloroform,Alcohol
• Indice di rifrazione: 1.3855
• Punto di infiammabilità (°F): 71.6 °F
• Punto di infiammabilità (°C): (closed cup)-4℃
• Punto di ebollizione (°C): 98.4°C
• Punto di fusione (°C): -90.7°C
• Peso molecolare: 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