3-Methoxybiphenyl - ≥96% , CAS No.2113-56-6

CAS: 2113-56-6 Cat. No.: M157896 Peso molecular: 184.24 Beilstein Registry Number: 6(4)4598 Número EC: 666-104-9
Disponible para pedir
GRADE & PURITY ≥96%
Synonyms
AKOS015962970 | Anisole, m-phenyl- | SCHEMBL12015208 | 3-methoxy biphenyl | 3-Methoxy-1,1'-biphenyl | MFCD00027514 | CAA11356 | SCHEMBL458391 | AS-58483 | 1-methoxy-3-phenylbenzene | 3-Methoxy-1,1'-biphenyl # | 3-phenylanisole | DTXSID60292969 | NSC86603
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
M157896-1g
5

53,90US$

80,90US$
Guardar 27,00 US$ (33.37%)
5g
M157896-5g
5

205,90US$

308,90US$
Guardar 103,00 US$ (33.34%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 1 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
AKOS015962970 | Anisole, m-phenyl- | SCHEMBL12015208 | 3-methoxy biphenyl | 3-Methoxy-1, 1'-biphenyl | MFCD00027514 | CAA11356 | SCHEMBL458391 | AS-58483 | 1-methoxy-3-phenylbenzene | 3-Methoxy-1, 1'-biphenyl # | 3-phenylanisole | DTXSID60292969 | NSC86603
Especificaciones y pureza
≥96%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥96%
Nombres e identificadores
Pubchem Sid488189090
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488189090
Sonrisas canónicasCOC1=CC=CC(=C1)C2=CC=CC=C2
IUPAC Name1-methoxy-3-phenylbenzene
InChIKeyKQMIWCAOEFUBQK-UHFFFAOYSA-N
INCHI1S/C13H12O/c1-14-13-9-5-8-12(10-13)11-6-3-2-4-7-11/h2-10H,1H3
Isómeros SMILES COC1=CC=CC(=C1)C2=CC=CC=C2
Peso molecular 184.24
Beilstein 6(4)4598
Reaxy-Rn 2207905
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2207905&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClaseBenzene and substituted derivatives
SubclassBiphenyls and derivatives
Intermediate Tree Nodes Not available
Direct ParentBiphenyls and derivatives
Alternative Parents Phenoxy compounds  Methoxybenzenes  Anisoles  Alkyl aryl ethers  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Biphenyl - Phenoxy compound - Methoxybenzene - Phenol ether - Anisole - Alkyl aryl ether - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
DescripciónThis 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
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
HT-29 (80576 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MCF7 (126967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

4 results found

Lot NumberCertificate TypeFechaArticulo
D2306384Certificate of AnalysisFeb 10, 2023 M157896
D2306385Certificate of AnalysisFeb 10, 2023 M157896
D2306512Certificate of AnalysisFeb 10, 2023 M157896
D2306520Certificate of AnalysisFeb 10, 2023 M157896
Propiedades químicas y físicas
Índice de refracción1.61
Punto de inflamación (°C)114 °C
Punto de ebullición (°C)140°C/5mmHg(lit.)
Peso molecular184.230 g/mol
XLogP33.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass184.089 Da
Monoisotopic Mass184.089 Da
Topological Polar Surface Area9.200 Ų
Heavy Atom Count14
Formal Charge0
Complexity161.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Referencias
1. Chencheng Xu, Jiangmin Jiang, Shuang Li, Zhan Wang, Gaoyu Zhou, Yaxin Chen, Xiangkai Kong, Quanchao Zhuang, Zhicheng Ju.  (2025)  Molecular tailoring engineering enables stable and efficient chemical pre-lithiation for graphite anodes in lithium-ion batteries.  JOURNAL OF POWER SOURCES,      [PMID:] [10.1016/j.jpowsour.2025.237971]
Calculadoras de soluciones
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