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

CAS: 2113-56-6 Cat. No.: M157896 Molecular Weight: 184.24 Beilstein Registry Number: 6(4)4598 EC Number: 666-104-9
AVAILABLE TO ORDER
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
Status
Price
Qty
1g
M157896-1g
5

$53.90

$80.90
Save $27.00 (33.37%)
5g
M157896-5g
5

$205.90

$308.90
Save $103.00 (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

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
Specifications & Purity
≥96%
Storage
Room temperature
Shipped In
Normal
Purity
≥96%
Names and Identifiers
Pubchem Sid488189090
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488189090
Canonical SmilesCOC1=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
Isomeric SMILES COC1=CC=CC(=C1)C2=CC=CC=C2
Molecular Weight 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
ClassBenzene 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
DescriptionThis 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
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
HT-29 (80576 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MCF7 (126967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
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 TypeDateItem
D2306384Certificate of AnalysisFeb 10, 2023 M157896
D2306385Certificate of AnalysisFeb 10, 2023 M157896
D2306512Certificate of AnalysisFeb 10, 2023 M157896
D2306520Certificate of AnalysisFeb 10, 2023 M157896
Chemical and Physical Properties
Refractive Index1.61
Flash Point(°C)114 °C
Boil Point(°C)140°C/5mmHg(lit.)
Molecular Weight184.230 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
References
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]
Solution Calculators
Reviews

Customer Reviews

Shall we send you a message when we have discounts available?

Remind me later

Thank you! Please check your email inbox to confirm.

Oops! Notifications are disabled.