Allylpentafluorobenzene - ≥98%(GC) , CAS No.1736-60-3

CAS: 1736-60-3 Cat. No.: A151406 Molecular Weight: 208.13 EC Number: 217-083-6
AVAILABLE TO ORDER
GRADE & PURITY ≥98%(GC)
Synonyms
J-010929 | 2,3,4,5,6-Pentafluoro(allylbenzene) | BENZENE, PENTAFLUORO-2-PROPENYL- | Allylpentafluorobenzene, 97% | 1-Allyl-2,3,4,5,6-pentafluorobenzene # | DTXSID50169636 | NSC 88279 | 1,2,3,4,5-pentafluoro-6-prop-2-enylbenzene | Benzene, 1,2,3,4,5-pentaf
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
A151406-1g
3

$9.90

$14.90
Save $5.00 (33.56%)
5g
A151406-5g
3

$32.90

$49.90
Save $17.00 (34.07%)
25g
A151406-25g
4

$124.90

$187.90
Save $63.00 (33.53%)
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Why this grade

≥98%(GC) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

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
J-010929 | 2, 3, 4, 5, 6-Pentafluoro(allylbenzene) | BENZENE, PENTAFLUORO-2-PROPENYL- | Allylpentafluorobenzene, 97% | 1-Allyl-2, 3, 4, 5, 6-pentafluorobenzene # | DTXSID50169636 | NSC 88279 | 1, 2, 3, 4, 5-pentafluoro-6-prop-2-enylbenzene | Benzene, 1, 2, 3, 4, 5-pentaf
Specifications & Purity
≥98%(GC)
Storage
Room temperature
Shipped In
Normal
Purity
≥98%(GC)
Names and Identifiers
Pubchem Sid504754814
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504754814
Canonical SmilesC=CCC1=C(C(=C(C(=C1F)F)F)F)F
IUPAC Name1,2,3,4,5-pentafluoro-6-prop-2-enylbenzene
InChIKeyYBDBTBVNQQBHGJ-UHFFFAOYSA-N
INCHI1S/C9H5F5/c1-2-3-4-5(10)7(12)9(14)8(13)6(4)11/h2H,1,3H2
Isomeric SMILES C=CCC1=C(C(=C(C(=C1F)F)F)F)F
WGK Germany 3
Molecular Weight 208.13
Reaxy-Rn 1971209
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1971209&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
ClassBenzene and substituted derivatives
SubclassHalobenzenes
Intermediate Tree Nodes Not available
Direct ParentFluorobenzenes
Alternative Parents Aryl fluorides  Organofluorides  Hydrofluorocarbons  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Fluorobenzene - Aryl halide - Aryl fluoride - Hydrofluorocarbon - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
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.

9 results found

Lot NumberCertificate TypeDateItem
L2511156Certificate of AnalysisDec 18, 2025 A151406
K2111344Certificate of AnalysisAug 12, 2025 A151406
K2111345Certificate of AnalysisAug 12, 2025 A151406
K2111346Certificate of AnalysisAug 12, 2025 A151406
E2319278Certificate of AnalysisNov 03, 2022 A151406
J2229084Certificate of AnalysisNov 03, 2022 A151406
J2229093Certificate of AnalysisNov 03, 2022 A151406
J2229094Certificate of AnalysisNov 03, 2022 A151406
E2319268Certificate of AnalysisOct 29, 2021 A151406
Chemical and Physical Properties
Refractive Index1.427
Flash Point(°F)109.4 °F
Flash Point(°C)42°C
Boil Point(°C)148-149°C
Molecular Weight208.130 g/mol
XLogP33.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass208.031 Da
Monoisotopic Mass208.031 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count14
Formal Charge0
Complexity191.000
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
Documents & Articles
Solution Calculators
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