Anisole - Standard for GC, ≥99.5%(GC) , CAS No.100-66-3

CAS: 100-66-3 Cat. No.: A103680 Formula: C7H8O Molecular Weight: 108.14 Beilstein Registry Number: 506892 EC Number: 202-876-1
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GRADE & PURITY Standard for GC ? GC reference standard — characterized compound for calibrating GC methods. Use to build calibration curves and verify GC quantitation. ≥99.5%(GC)
Synonyms
Methoxybenzene | Methyl phenyl ether
Storage
Protected from light,Room temperature,Argon charged
Shipped In
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Size
USA
Germany (EU)*
Price
Qty
5ml
A103680-5ml
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$17.90

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Why this grade

Standard for GC, ≥99.5%(GC) Standard for GC for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Protected from light,Room temperature,Argon charged Ships FedEx DG Service Check lot-specific COA for exact specifications.

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Quality documents

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

📚

Literature proof

Cited in 139 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

A biochemical for proteomics research.

Specifications

Synonyms
Methoxybenzene | Methyl phenyl ether
Specifications & Purity
Standard for GC, ≥99.5%(GC)
Storage
Protected from light,Room temperature,Argon charged
Shipped In
FedEx DG Service
Grade
Standard for GC
Purity
≥99.5%(GC)
Names and Identifiers
Pubchem Sid508816437
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/508816437
Canonical SmilesCOC1=CC=CC=C1
IUPAC Nameanisole
InChIKeyRDOXTESZEPMUJZ-UHFFFAOYSA-N
INCHI1S/C7H8O/c1-8-7-5-3-2-4-6-7/h2-6H,1H3
Isomeric SMILES COC1=CC=CC=C1
WGK Germany 2
UN Number 2222
Packing Group III
Molecular Weight 108.14
Beilstein 506892
Reaxy-Rn 506892
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=506892&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
ClassPhenol ethers
SubclassAnisoles
Intermediate Tree Nodes Not available
Direct ParentAnisoles
Alternative Parents Phenoxy compounds  Methoxybenzenes  Alkyl aryl ethers  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenoxy compound - Methoxybenzene - Anisole - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
External Descriptors a small molecule
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
ESR1 Tclin Estrogen receptor alpha (17718 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CA6 Tclin Carbonic anhydrase VI (993 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ALB Tchem Serum albumin (2651 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
CA4 Carbonic anhydrase IV (1713 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.

6 results found

Lot NumberCertificate TypeDateItem
D2319118Certificate of AnalysisSep 22, 2026 A103680
E2526210Certificate of AnalysisMay 29, 2025 A103680
G2425097Certificate of AnalysisJul 15, 2024 A103680
E2129021Certificate of AnalysisMar 09, 2023 A103680
I2209352Certificate of AnalysisSep 02, 2022 A103680
E2028108Certificate of AnalysisApr 25, 2022 A103680
Chemical and Physical Properties
SolubilityInsoluble in water, soluble in ethanol and ether.
SensitivityLight sensitive.Moisture sensitive
Flash Point(°F)109℉
Flash Point(°C)43°C
Boil Point(°C)154°C
Melt Point(°C)-37 °C
Molecular Weight108.140 g/mol
XLogP32.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass108.058 Da
Monoisotopic Mass108.058 Da
Topological Polar Surface Area9.200 Ų
Heavy Atom Count8
Formal Charge0
Complexity55.400
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
Documents & Articles
Standard for GC: A Practical Guide
A Complete Guide to Choosing Resins for SPPS (Solid-Phase Peptide Synthesis): Fmoc/Boc Routes, C-Terminal Acid/Amide, and a Key-Parameter Navigator
One Atom Can Change a Drug’s Fate: Atom-Level Knobs and a Functional-Group Toolbox for Medicinal Chemistry (Methyl / Halogen Bonding / 3D Building Blocks / Late-Stage Fluorination + Product-Selection Tables)
From the Logic of Deprotection to Protecting Group Choice: Differences Among Bn, PMB, and Dmb in Experimental Design
Boc₂O Selection Cannot Be Judged by Protection Installation Alone: Experimental Decision-Making from Substrate Nucleophilicity and Medium Effects to Deprotection Pathways
How to Troubleshoot Abnormal Impurities in Peptide Synthesis? Locating Process Issues Through Amino-Related Side Reactions
Formation and Control of Carboxyl- and Hydroxyl-Related Impurities in Peptide Synthesis — Using Asp/Glu and Ser/Thr Residue Side Reactions as Examples
Citations of This Product
Solution Calculators
Reviews

Customer Reviews

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