1-Chloro-2-methylpentane - ≥98%(GC) , CAS No.14753-05-0

CAS: 14753-05-0 Cat. No.: C153663 Formule: C₆H₁₃Cl Poids moléculaire: 120.62 Beilstein Registry Number: 1(2)111

QUALITÉ & PURETÉ ≥98%(GC)

Synonyms

BS-20615 | AKOS009157400 | 1-Chloro-2-methylpentane | SLBTUZZYJLBZQV-UHFFFAOYSA-N | SCHEMBL1286260 | MFCD00053236 | Pentane, 1-chloro-2-methyl | Pentane, 1-chloro-2-methyl- | DTXSID20335907 | D89415 | EN300-61698

Storage

Room temperature

Shipped In

Normal

Spécifications

Synonymes

BS-20615 | AKOS009157400 | 1-Chloro-2-methylpentane | SLBTUZZYJLBZQV-UHFFFAOYSA-N | SCHEMBL1286260 | MFCD00053236 | Pentane, 1-chloro-2-methyl | Pentane, 1-chloro-2-methyl- | DTXSID20335907 | D89415 | EN300-61698

Spécifications et pureté

≥98%(GC)

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥98%(GC)

Noms et identifiants

Pubchem Sid

528754473

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/528754473

Sourires canoniques

CCCC(C)CCl

IUPAC Name

1-chloro-2-methylpentane

InChIKey

SLBTUZZYJLBZQV-UHFFFAOYSA-N

INCHI

1S/C6H13Cl/c1-3-4-6(2)5-7/h6H,3-5H2,1-2H3

Isomères SMILES

CCCC(C)CCl

Numéro ONU

1993

Groupe d'emballage

III

Poids moléculaire

120.62

Beilstein

1(2)111

Reaxy-Rn

1731287

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731287&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Organochlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Organochlorides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organochlorides
• Alternative Parents: Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organochloride - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as organochlorides. These are compounds containing a chemical bond between a carbon atom and a chlorine atom.
• 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

Propriétés chimiques et physiques

• Solubilité: Water solubility: insoluble
• Sensibilité: heat sensitive
• Indice de réfraction: 1.42
• Point d'éclair (°C): 25 °C
• Point d'ébullition (°C): 120°C(lit.)
• Poids moléculaire: 120.620 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 3
• Exact Mass: 120.071 Da
• Monoisotopic Mass: 120.071 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 35.200
• 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

Foire aux questions

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% 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 14753-05-0, the molecular formula is C6H13Cl, and the molecular weight is 120.62 g/mol. InChIKey SLBTUZZYJLBZQV-UHFFFAOYSA-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.