6-Chlor-1-hexanol - ≥95% , CAS No.2009-83-8

CAS: 2009-83-8 Cat. No.: C109454 Summenformel: C₆H₁₃ClO Molekulargewicht: 136.62 Beilstein Registry Number: 1697307 EG-Nummer: 217-925-2

GRADE & PURITY ≥95%

Synonyms

.OMEGA.-CHLOROHEXANOL | CAS-2009-83-8 | NCGC00260358-01 | 4-01-00-01704 (Beilstein Handbook Reference) | MFCD00129813 | NSC-3700 | omega-Chlorohexanol | 6-Chlorohexanol | 6-chloro-hexanol | HY-41681 | 6-chloro-hexan-1-ol | 6-chlorohexan-1ol | 6-Chlorohexa

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

.OMEGA.-CHLOROHEXANOL | CAS-2009-83-8 | NCGC00260358-01 | 4-01-00-01704 (Beilstein Handbook Reference) | MFCD00129813 | NSC-3700 | omega-Chlorohexanol | 6-Chlorohexanol | 6-chloro-hexanol | HY-41681 | 6-chloro-hexan-1-ol | 6-chlorohexan-1ol | 6-Chlorohexa

Spezifikationen & Reinheit

≥95%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥95%

Namen und Kennungen

Pubchem Sid

504754867

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504754867

Kanonisches Lächeln

C(CCCCl)CCO

IUPAC Name

6-chlorohexan-1-ol

InChIKey

JNTPTNNCGDAGEJ-UHFFFAOYSA-N

INCHI

1S/C6H13ClO/c7-5-3-1-2-4-6-8/h8H,1-6H2

Isomere SMILES

C(CCCCl)CCO

WGK Deutschland

3

RTECS

MO9160000

UN-Nummer

1993

Molekulargewicht

136.62

Beilstein

1697307

Reaxy-Rn

1697307

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1697307&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Klasse Organooxygen compounds
      • Subclass Alcohols and polyols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Klasse: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Not available
• Direct Parent: Primary alcohols
• Alternative Parents: Organochlorides Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Primary alcohol - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as primary alcohols. These are compounds comprising the primary alcohol functional group, with the general structure RCOH (R=alkyl, aryl).
• 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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in dimethylformamide.
• Brechungsindex: 1.4547-1.4567
• Flammpunkt (°F): 210.2 °F
• Flammpunkt (°C): 98℃
• Siedepunkt (°C): 108-112 °C/14 mmHg
• Molekulargewicht: 136.620 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 136.065 Da
• Monoisotopic Mass: 136.065 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 39.500
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥95% purity (chemical assay). 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 2009-83-8, the molecular formula is C6H13ClO, and the molecular weight is 136.62 g/mol. InChIKey JNTPTNNCGDAGEJ-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.