2,6-dibromo-4-fluoro-benzaldehyde - ≥97% , CAS No.938467-02-8

CAS: 938467-02-8 Cat. No.: D636152 분자식: C₇H₃OFBr₂ 분자량: 281.9 EC 번호: 182-119-9

GRADE & PURITY ≥97%

Synonyms

2,6-DIBROMO-4-FLUOROBENZALDEHYDE | 938467-02-8 | 2,6-Dibromo-4-fluoro-benzaldehyde | 2,6-dibromo-4-fluoro- Benzaldehyde | MFCD13186760 | SCHEMBL1726007 | AKOS027256121 | AB93074 | AM805195 | AS-39672 | SY126642 | EN300-373831 | A934676 | Z1269117182

Storage

Room temperature

Shipped In

Normal

Specifications

동의어

2,6-DIBROMO-4-FLUOROBENZALDEHYDE | 938467-02-8 | 2,6-Dibromo-4-fluoro-benzaldehyde | 2,6-dibromo-4-fluoro- Benzaldehyde | MFCD13186760 | SCHEMBL1726007 | AKOS027256121 | AB93074 | AM805195 | AS-39672 | SY126642 | EN300-373831 | A934676 | Z1269117182

사양 및 순도

≥97%

보관 조건

Room temperature

배송

Normal

순수함

≥97%

이름과 식별자

• 정식 스마일: C1=C(C=C(C(=C1Br)C=O)Br)F
• IUPAC Name: 2,6-dibromo-4-fluorobenzaldehyde
• InChIKey: ULSMYJACTJXCRB-UHFFFAOYSA-N
• INCHI: 1S/C7H3Br2FO/c8-6-1-4(10)2-7(9)5(6)3-11/h1-3H
• 이성체 SMILES: C1=C(C=C(C(=C1Br)C=O)Br)F
• 분자량: 281.9
• Reaxy-Rn: 19958472
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=19958472&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • 분류 Benzene and substituted derivatives
      • Subclass Benzoyl derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Benzoyl derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzoyl derivatives
• Alternative Parents: Benzaldehydes Fluorobenzenes Bromobenzenes Aryl fluorides Aryl bromides Vinylogous halides Organofluorides Organobromides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzaldehyde - Benzoyl - Bromobenzene - Fluorobenzene - Aryl-aldehyde - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Vinylogous halide - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aldehyde - Organohalogen compound - Organobromide - Organofluoride - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
• 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

화학 및 물리적 특성

• 녹는점(°C): 86.6-87.4
• 분자량: 281.900 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 281.851 Da
• Monoisotopic Mass: 279.853 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 141.000
• 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

자주 묻는 질문

What is the purity of this product?

This product is supplied at ≥97% 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 938467-02-8, the molecular formula is C7H3OFBr2, and the molecular weight is 281.9 g/mol. InChIKey ULSMYJACTJXCRB-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.