1,8-Dichlorohexadecafluorooctane - ≥98% , CAS No.647-25-6

CAS: 647-25-6 Cat. No.: D155438 Molecular Weight: 470.96 EC Number: 671-649-0
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
TK0PEB8Q3S | 1,8-dichloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctane | 1,8-dichloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluoro-octane | Q27118005 | D90116 | 1,1-ISOPROPYLIDENEZIRCONOCENEDICHLORIDE | BS-43786 | GFQXWORJCNTDPU-UHFFFAOYSA-N | O
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
D155438-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$18.90
5g
D155438-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$44.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥98% 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.

📚

Literature proof

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

Specifications

Synonyms
TK0PEB8Q3S | 1, 8-dichloro-1, 1, 2, 2, 3, 3, 4, 4, 5, 5, 6, 6, 7, 7, 8, 8-hexadecafluorooctane | 1, 8-dichloro-1, 1, 2, 2, 3, 3, 4, 4, 5, 5, 6, 6, 7, 7, 8, 8-hexadecafluoro-octane | Q27118005 | D90116 | 1, 1-ISOPROPYLIDENEZIRCONOCENEDICHLORIDE | BS-43786 | GFQXWORJCNTDPU-UHFFFAOYSA-N | O
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Canonical SmilesC(C(C(C(C(F)(F)Cl)(F)F)(F)F)(F)F)(C(C(C(F)(F)Cl)(F)F)(F)F)(F)F
IUPAC Name1,8-dichloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8-hexadecafluorooctane
InChIKeyGFQXWORJCNTDPU-UHFFFAOYSA-N
INCHI1S/C8Cl2F16/c9-7(23,24)5(19,20)3(15,16)1(11,12)2(13,14)4(17,18)6(21,22)8(10,25)26
Isomeric SMILES C(C(C(C(C(F)(F)Cl)(F)F)(F)F)(F)F)(C(C(C(F)(F)Cl)(F)F)(F)F)(F)F
Molecular Weight 470.96
Reaxy-Rn 2483941
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2483941&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
SuperclassOrganohalogen compounds
ClassAlkyl halides
SubclassAlkyl chlorides
Intermediate Tree Nodes Not available
Direct ParentChlorofluorocarbons
Alternative Parents Organofluorides  Organochlorides  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Chlorofluorocarbon - Hydrocarbon derivative - Organofluoride - Organochloride - Alkyl fluoride - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as chlorofluorocarbons. These are alkyhalide compounds that are composed only of chlorine, fluorine, and carbon atoms.
External Descriptors organofluorine compound - organochlorine compound
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
Boil Point(°C)115 °C/200 mmHg
Molecular Weight470.960 g/mol
XLogP37.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count16
Rotatable Bond Count7
Exact Mass469.912 Da
Monoisotopic Mass469.912 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count26
Formal Charge0
Complexity488.000
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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