2-Chloro-5-fluoroanisole - ≥97% , CAS No.450-89-5

CAS: 450-89-5 Cat. No.: C122584 Molecular Weight: 160.57 Beilstein Registry Number: 6(3)699 EC Number: 610-224-6
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
AM61989 | AKOS015890089 | 1-Chloro-2-methoxy-4-fluorobenzene;2-Chloro-5-fluoroanisole1-Chloro-4-fluoro-2-methoxybenzene | DTXSID60369145 | A19856 | AS-19054 | ULVPJKKERHMKLS-UHFFFAOYSA-N | FT-0611819 | AC-3771 | C2216 | Benzene, 1-chloro-4-fluoro-2-methox
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
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1g
C122584-1g
5

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5g
C122584-5g
2

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10g
C122584-10g
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25g
C122584-25g
1

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100g
C122584-100g
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal 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.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
AM61989 | AKOS015890089 | 1-Chloro-2-methoxy-4-fluorobenzene;2-Chloro-5-fluoroanisole1-Chloro-4-fluoro-2-methoxybenzene | DTXSID60369145 | A19856 | AS-19054 | ULVPJKKERHMKLS-UHFFFAOYSA-N | FT-0611819 | AC-3771 | C2216 | Benzene, 1-chloro-4-fluoro-2-methox
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Pubchem Sid504760892
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504760892
Canonical SmilesCOC1=C(C=CC(=C1)F)Cl
IUPAC Name1-chloro-4-fluoro-2-methoxybenzene
InChIKeyULVPJKKERHMKLS-UHFFFAOYSA-N
INCHI1S/C7H6ClFO/c1-10-7-4-5(9)2-3-6(7)8/h2-4H,1H3
Isomeric SMILES COC1=C(C=CC(=C1)F)Cl
Molecular Weight 160.57
Beilstein 6(3)699
Reaxy-Rn 3240534
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3240534&ln=

Documentation

📋 Safety Data Sheet (SDS)

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

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✅ Certificate of Analysis (COA)

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

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassPhenol ethers
SubclassAnisoles
Intermediate Tree Nodes Not available
Direct ParentAnisoles
Alternative Parents Phenoxy compounds  Methoxybenzenes  Fluorobenzenes  Chlorobenzenes  Alkyl aryl ethers  Aryl fluorides  Aryl chlorides  Organofluorides  Organochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Fluorobenzene - Halobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Ether - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organofluoride - Organochloride - Organohalogen 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 Not available
3D Structure
Interactive Chemical Structure Model





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.

7 results found

Lot NumberCertificate TypeDateItem
I2201026Certificate of AnalysisJun 11, 2026 C122584
J1817116Certificate of AnalysisMay 20, 2026 C122584
I1411087Certificate of AnalysisApr 15, 2026 C122584
D1423004Certificate of AnalysisNov 10, 2025 C122584
L2319127Certificate of AnalysisDec 25, 2023 C122584
L2206117Certificate of AnalysisDec 14, 2022 C122584
J1817115Certificate of AnalysisAug 09, 2022 C122584
Chemical and Physical Properties
Refractive Index1.52
Flash Point(°C)57 °C
Boil Point(°C)195°C
Molecular Weight160.570 g/mol
XLogP32.800
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass160.009 Da
Monoisotopic Mass160.009 Da
Topological Polar Surface Area9.200 Ų
Heavy Atom Count10
Formal Charge0
Complexity110.000
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
Solution Calculators
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