2-메톡시비페닐 - ≥98%(GC) , CAS No.86-26-0

CAS: 86-26-0 Cat. No.: M157898 분자식: C₁₃H₁₂O 분자량: 184.24 Beilstein Registry Number: 6(4)4580 EC 번호: 201-659-9

GRADE & PURITY ≥98%(GC)

Synonyms

2-METHOXY BIPHENYL | 2-Hydroxybiphenyl methyl ether | 2-Phenylanisole | MFCD00008367 | AI3-00236 | Anisole, o-phenyl- | FT-0612830 | InChI=1/C13H12O/c1-14-13-10-6-5-9-12(13)11-7-3-2-4-8-11/h2-10H,1H3 | 1,1'-Biphenyl, methoxy- | 2-Methoxy-biphenylate | EIN

Storage

Room temperature

Shipped In

보통

개요

응용 분야: 용도
2-메톡시비페닐은 화학 및 유기 중간체로 사용됩니다.

Specifications

동의어

2-METHOXY BIPHENYL | 2-Hydroxybiphenyl methyl ether | 2-Phenylanisole | MFCD00008367 | AI3-00236 | Anisole, o-phenyl- | FT-0612830 | InChI=1/C13H12O/c1-14-13-10-6-5-9-12(13)11-7-3-2-4-8-11/h2-10H,1H3 | 1,1'-Biphenyl, methoxy- | 2-Methoxy-biphenylate | EIN

사양 및 순도

≥98%(GC)

보관 조건

Room temperature

배송

보통

순수함

≥98%(GC)

이름과 식별자

• Pubchem Sid: 488180170
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488180170
• 정식 스마일: COC1=CC=CC=C1C2=CC=CC=C2
• IUPAC Name: 1-methoxy-2-phenylbenzene
• InChIKey: NLWCWEGVNJVLAX-UHFFFAOYSA-N
• INCHI: 1S/C13H12O/c1-14-13-10-6-5-9-12(13)11-7-3-2-4-8-11/h2-10H,1H3
• 이성체 SMILES: COC1=CC=CC=C1C2=CC=CC=C2
• RTECS: BZ8835000
• 분자량: 184.24
• Beilstein: 6(4)4580
• Reaxy-Rn: 2045749
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2045749&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• 분류: Benzene and substituted derivatives
• Subclass: Biphenyls and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Biphenyls and derivatives
• Alternative Parents: Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Biphenyl - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - Alkyl aryl ether - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as biphenyls and derivatives. These are organic compounds containing to benzene rings linked together by a C-C bond.
• 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)

HT-29 (80576 Activities)

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

MCF7 (126967 Activities)

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

작용 메커니즘

화학 및 물리적 특성

• 용해성: Soluble in toluene. Insoluble in water.
• 굴절률: 1.61
• 발화점(°F): 230°F
• 발화점(°C): >110℃
• 끓는점(°C): 274°C(lit.)
• 녹는점(°C): 28 °C
• 분자량: 184.230 g/mol
• XLogP3: 3.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 184.089 Da
• Monoisotopic Mass: 184.089 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 161.000
• 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, 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.

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 86-26-0, the molecular formula is C13H12O, and the molecular weight is 184.24 g/mol. InChIKey NLWCWEGVNJVLAX-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.