(Bromomethyl)cyclohexane - ≥99% , CAS No.2550-36-9

CAS: 2550-36-9 Cat. No.: B121199 Summenformel: C₇H₁₃Br Molekulargewicht: 177.08 Beilstein Registry Number: 635738 EG-Nummer: 627-441-7

GRADE & PURITY ≥99%

Synonyms

(cyclohexylmethyl)bromide | DIETHYLAMINOPHENOL, 3- | MFCD00001509 | 1-bromomethylcyclohexane | (bromomethyl)cyclohexane;1-Cyclohexyl-1-bromo-methane | bromomethyl cyclohexane | AS-18237 | Cyclohexylmethylbromide | (Bromomethyl)cyclohexane | (bromo-methyl)

Storage

Room temperature

Shipped In

Normal

Übersicht

(Bromomethyl)cyclohexane is an important raw material and intermediate used in organic synthesis, pharmaceuticals and agrochemicals.

Specifications

Synonyme

(cyclohexylmethyl)bromide | DIETHYLAMINOPHENOL, 3- | MFCD00001509 | 1-bromomethylcyclohexane | (bromomethyl)cyclohexane;1-Cyclohexyl-1-bromo-methane | bromomethyl cyclohexane | AS-18237 | Cyclohexylmethylbromide | (Bromomethyl)cyclohexane | (bromo-methyl)

Spezifikationen & Reinheit

≥99%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥99%

Namen und Kennungen

• Pubchem Sid: 488187959
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488187959
• Kanonisches Lächeln: C1CCC(CC1)CBr
• IUPAC Name: bromomethylcyclohexane
• InChIKey: UUWSLBWDFJMSFP-UHFFFAOYSA-N
• INCHI: 1S/C7H13Br/c8-6-7-4-2-1-3-5-7/h7H,1-6H2
• Isomere SMILES: C1CCC(CC1)CBr
• WGK Deutschland: 3
• Molekulargewicht: 177.08
• Beilstein: 635738
• Reaxy-Rn: 635738
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=635738&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Klasse Organobromides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Klasse: Organobromides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organobromides
• Alternative Parents: Hydrocarbon derivatives Alkyl bromides
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Hydrocarbon derivative - Organobromide - Alkyl halide - Alkyl bromide - Aliphatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as organobromides. These are compounds containing a chemical bond between a carbon atom and a bromine 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Insoluble in water.
• Brechungsindex: 1.4935
• Flammpunkt (°F): 134.6 °F
• Flammpunkt (°C): 68°C(154°F)
• Siedepunkt (°C): 99-100°C/40mm
• Molekulargewicht: 177.080 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 176.02 Da
• Monoisotopic Mass: 176.02 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 55.400
• 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

Referenzen

1. Qin Tang, Fangling Ji, Jianli Guo, Jingyun Wang, Yachen Li, Yongming Bao.  (2016)  Directional modification of chrysin for exerting apoptosis and enhancing significantly anti-cancer effects of 10-hydroxy camptothecin.  BIOMEDICINE & PHARMACOTHERAPY,      [PMID:27470413] [10.1016/j.biopha.2016.06.008]

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥99% 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 2550-36-9, the molecular formula is C7H13Br, and the molecular weight is 177.08 g/mol. InChIKey UUWSLBWDFJMSFP-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.