2-Brom-4-chloranisol - ≥98% , CAS No.60633-25-2

CAS: 60633-25-2 Cat. No.: B101886 Summenformel: C₇H₆BrClO Molekulargewicht: 221.48 EG-Nummer: 612-004-5

GRADE & PURITY ≥98%

Synonyms

2-Bromo-4-chloroanisole | 2-bromo4-chloroanisole | F10964 | PS-7849 | EN300-23993 | FT-0611442 | 2-Bromo-4-chloro-1-methoxybenzene # | B3111 | SY016835 | AKOS000121084 | DTXSID70334788 | SCHEMBL929274 | 2-Bromo-4-chloro-1-methoxybenzene | 2-bromo-4-chloro

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

2-Bromo-4-chloroanisole | 2-bromo4-chloroanisole | F10964 | PS-7849 | EN300-23993 | FT-0611442 | 2-Bromo-4-chloro-1-methoxybenzene # | B3111 | SY016835 | AKOS000121084 | DTXSID70334788 | SCHEMBL929274 | 2-Bromo-4-chloro-1-methoxybenzene | 2-bromo-4-chloro

Spezifikationen & Reinheit

≥98%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥98%

Namen und Kennungen

• Pubchem Sid: 488190113
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488190113
• Kanonisches Lächeln: COC1=C(C=C(C=C1)Cl)Br
• IUPAC Name: 2-bromo-4-chloro-1-methoxybenzene
• InChIKey: YJEMGEBDXDPBSP-UHFFFAOYSA-N
• INCHI: 1S/C7H6BrClO/c1-10-7-3-2-5(9)4-6(7)8/h2-4H,1H3
• Isomere SMILES: COC1=C(C=C(C=C1)Cl)Br
• Molekulargewicht: 221.48
• Reaxy-Rn: 3240478
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3240478&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Phenol ethers
      • Subclass Anisoles

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Phenol ethers
• Subclass: Anisoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Anisoles
• Alternative Parents: Phenoxy compounds Methoxybenzenes Chlorobenzenes Bromobenzenes Alkyl aryl ethers Aryl chlorides Aryl bromides Organochlorides Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Halobenzene - Bromobenzene - Chlorobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Ether - Organohalogen compound - Organobromide - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Aromatic homomonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
• 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: 1.59
• Siedepunkt (°C): 127°C/17mmHg
• Molekulargewicht: 221.480 g/mol
• XLogP3: 3.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 219.929 Da
• Monoisotopic Mass: 219.929 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 110.000
• 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

Häufig gestellte Fragen

How should this product be stored?

Store at room temperature.

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

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 60633-25-2, the molecular formula is C7H6BrClO, and the molecular weight is 221.48 g/mol. InChIKey YJEMGEBDXDPBSP-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.