2,4-Difluoroaniline - ≥98%(GC) , CAS No.367-25-9

CAS: 367-25-9 Cat. No.: D135481 분자식: C₆H₅F₂N 분자량: 129.11 Beilstein Registry Number: 12(1)297 EC 번호: 206-687-5

GRADE & PURITY ≥98%(GC)

Synonyms

BRN 2802556 | 2,4-Difluroaniline | 2,4-difluoro-anilin;Aniline, 2,4-difluoro-;Benzenamine, 2,4-difluoro- | UNII-40P93L7KWD | 2,4-Difluoro Aniline | FT-0601172 | 2,4-Difluoroaniline, 99% | PS-9155 | W-106593 | A25254 | DTXSID6025064 | 2, 4-Difluoroaniline

Storage

Room temperature,Argon charged

Shipped In

Normal

개요

2,4-Difluoroaniline is an important raw material and intermediate used in organic synthesis, pharmaceuticals agrochemicals and dyestuff fields.

Specifications

동의어

BRN 2802556 | 2,4-Difluroaniline | 2,4-difluoro-anilin;Aniline, 2,4-difluoro-;Benzenamine, 2,4-difluoro- | UNII-40P93L7KWD | 2,4-Difluoro Aniline | FT-0601172 | 2,4-Difluoroaniline, 99% | PS-9155 | W-106593 | A25254 | DTXSID6025064 | 2, 4-Difluoroaniline

사양 및 순도

≥98%(GC)

보관 조건

Room temperature,Argon charged

배송

Normal

순수함

≥98%(GC)

이름과 식별자

• Pubchem Sid: 504751859
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504751859
• 정식 스마일: C1=CC(=C(C=C1F)F)N
• IUPAC Name: 2,4-difluoroaniline
• InChIKey: CEPCPXLLFXPZGW-UHFFFAOYSA-N
• INCHI: 1S/C6H5F2N/c7-4-1-2-6(9)5(8)3-4/h1-3H,9H2
• 이성체 SMILES: C1=CC(=C(C=C1F)F)N
• WGK 독일: 1
• RTECS: BX3680000
• UN 번호: 2941
• 포장 그룹: III
• 분자량: 129.11
• Beilstein: 12(1)297
• Reaxy-Rn: 2802556
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2802556&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Aniline and substituted anilines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aniline and substituted anilines
• Alternative Parents: Fluorobenzenes Aryl fluorides Primary amines Organopnictogen compounds Organofluorides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - Halobenzene - Fluorobenzene - Aryl halide - Aryl fluoride - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
• 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

관련 대상(인간)

ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)

Discover Target: ALDH1A1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

작용 메커니즘

화학 및 물리적 특성

• 감도: air sensitive
• 굴절률: 1.506
• 발화점(°F): 143.6 °F
• 발화점(°C): 62°C(lit.)
• 끓는점(°C): 170 °C/753
• 녹는점(°C): -7.5°C
• 분자량: 129.110 g/mol
• XLogP3: 1.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 129.039 Da
• Monoisotopic Mass: 129.039 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 97.100
• 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, and how is it determined?

This product is supplied at ≥98% 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 under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

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 367-25-9, the molecular formula is C6H5F2N, and the molecular weight is 129.11 g/mol. InChIKey CEPCPXLLFXPZGW-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.