1-Bromo-3，7-dimethyloctane - ≥96% , CAS No.3383-83-3

CAS: 3383-83-3 Cat. No.: B137574 Summenformel: C₁₀H₂₁Br Molekulargewicht: 221.18 EG-Nummer: 807-978-5

GRADE & PURITY ≥96%

Synonyms

1-Bromo-3,7-dimethyl octane | (+/-)-1-bromo-3,7-dimethyloctane | 1-Bromo-3,7-dimethyloctane, 96% | SY276637 | 1-Bromo-3,7-dimethyloctane, technical grade | 3,7 dimethyloctylbromide | DTXSID70955417 | DS-4865 | 3,7-Dimethyloctyl bromide | 3,7-dimethylbromo

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

1-Bromo-3,7-dimethyl octane | (+/-)-1-bromo-3,7-dimethyloctane | 1-Bromo-3,7-dimethyloctane, 96% | SY276637 | 1-Bromo-3,7-dimethyloctane, technical grade | 3,7 dimethyloctylbromide | DTXSID70955417 | DS-4865 | 3,7-Dimethyloctyl bromide | 3,7-dimethylbromo

Spezifikationen & Reinheit

≥96%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥96%

Namen und Kennungen

Pubchem Sid

504757144

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504757144

Kanonisches Lächeln

CC(C)CCCC(C)CCBr

IUPAC Name

1-bromo-3,7-dimethyloctane

InChIKey

VGSUDZKDSKCYJP-UHFFFAOYSA-N

INCHI

1S/C10H21Br/c1-9(2)5-4-6-10(3)7-8-11/h9-10H,4-8H2,1-3H3

Isomere SMILES

CC(C)CCCC(C)CCBr

WGK Deutschland

3

Molekulargewicht

221.18

Reaxy-Rn

1719643

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1719643&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 acyclic compounds
• Substituents: Hydrocarbon derivative - Organobromide - Alkyl halide - Alkyl bromide - Aliphatic acyclic 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

• Brechungsindex: 1.45
• Flammpunkt (°F): 208.4 °F
• Flammpunkt (°C): 98 °C
• Siedepunkt (°C): 217 °C
• Molekulargewicht: 221.180 g/mol
• XLogP3: 5.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 6
• Exact Mass: 220.083 Da
• Monoisotopic Mass: 220.083 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 78.900
• 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