4-Phenoxybutyl Bromide - ≥96%(GC) , CAS No.1200-03-9

CAS: 1200-03-9 Cat. No.: P160718 Formula: C₁₀H₁₃BrO Peso molecolare: 229.12 Beilstein Registry Number: 6(4)558 Numero EC: 214-849-1 PubChem CID: 70986

GRADE & PURITY ≥96%(GC)

Synonyms

4-phenoxy-1-bromobutane | 4-phenoxy-1-butylbromide | AKOS000343515 | 4-Bromobutyl phenyl ether, 97% | 1-Brom-4-phenoxybutan | EN300-85792 | Benzene, (4-bromobutoxy)- | UNII-934T64RMNJ | MFCD00000262 | SY010804 | (4-Bromobutoxy)benzene | (4-Bromo-butoxy)-b

Storage

Room temperature

Shipped In

Normal

Specifications

Sinonimi

4-phenoxy-1-bromobutane | 4-phenoxy-1-butylbromide | AKOS000343515 | 4-Bromobutyl phenyl ether, 97% | 1-Brom-4-phenoxybutan | EN300-85792 | Benzene, (4-bromobutoxy)- | UNII-934T64RMNJ | MFCD00000262 | SY010804 | (4-Bromobutoxy)benzene | (4-Bromo-butoxy)-b

Specifiche e purezza

≥96%(GC)

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Purezza

≥96%(GC)

Nomi e identificatori

• Pubchem Sid: 488184627
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488184627
• Sorrisi canonici: C1=CC=C(C=C1)OCCCCBr
• IUPAC Name: 4-bromobutoxybenzene
• InChIKey: QBLISOIWPZSVIK-UHFFFAOYSA-N
• INCHI: 1S/C10H13BrO/c11-8-4-5-9-12-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9H2
• Isomeri SMILES: C1=CC=C(C=C1)OCCCCBr
• WGK Germania: 3
• PubChem CID: 70986
• Peso molecolare: 229.12
• Beilstein: 6(4)558
• Reaxy-Rn: 2044374

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenol ethers

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenol ethers
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenol ethers
• Alternative Parents: Phenoxy compounds Alkyl aryl ethers Organobromides Hydrocarbon derivatives Alkyl bromides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
• 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

Proprietà chimiche e fisiche

• Punto di infiammabilità (°F): >235.4 °F
• Punto di infiammabilità (°C): >113 °C
• Punto di ebollizione (°C): 156°C/18mmHg(lit.)
• Punto di fusione (°C): 41 °C
• Peso molecolare: 229.110 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 228.015 Da
• Monoisotopic Mass: 228.015 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 100.000
• 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

Domande frequenti

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

This product is supplied at ≥96% 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 1200-03-9, the molecular formula is C10H13BrO, and the molecular weight is 229.12 g/mol. InChIKey QBLISOIWPZSVIK-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.