Dodecafluorosuberic Acid - ≥97%(T) , CAS No.678-45-5

CAS: 678-45-5 Cat. No.: D155934 Molecular Weight: 390.08 EC Number: 670-455-3
AVAILABLE TO ORDER
GRADE & PURITY ≥97%(T)
Synonyms
Dodecafluoro-1,8-octanedioic Acid | Perfluoro-1,8-octanedioic Acid | Perfluorosuberic Acid
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
D155934-1g
3
$39.90
5g
D155934-5g
4
$109.90
25g
D155934-25g
4
$499.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥97%(T) 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
Dodecafluoro-1, 8-octanedioic Acid | Perfluoro-1, 8-octanedioic Acid | Perfluorosuberic Acid
Specifications & Purity
≥97%(T)
Storage
Room temperature
Shipped In
Normal
Purity
≥97%(T)
Names and Identifiers
Pubchem Sid488192370
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488192370
Canonical SmilesC(=O)(C(C(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
IUPAC Name2,2,3,3,4,4,5,5,6,6,7,7-dodecafluorooctanedioic acid
InChIKeyQYCPVKMFWNBDPV-UHFFFAOYSA-N
INCHI1S/C8H2F12O4/c9-3(10,1(21)22)5(13,14)7(17,18)8(19,20)6(15,16)4(11,12)2(23)24/h(H,21,22)(H,23,24)
Isomeric SMILES C(=O)(C(C(C(C(C(C(C(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O
Molecular Weight 390.08
Reaxy-Rn 1895713
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1895713&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
SuperclassLipids and lipid-like molecules
ClassFatty Acyls
SubclassFatty acids and conjugates
Intermediate Tree Nodes Not available
Direct ParentMedium-chain fatty acids
Alternative Parents Halogenated fatty acids  Dicarboxylic acids and derivatives  Alpha-halocarboxylic acids  Carboxylic acids  Organofluorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl fluorides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Medium-chain fatty acid - Halogenated fatty acid - Dicarboxylic acid or derivatives - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organofluoride - Organohalogen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Alkyl fluoride - Alkyl halide - Organooxygen compound - Hydrocarbon derivative - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as medium-chain fatty acids. These are fatty acids with an aliphatic tail that contains between 4 and 12 carbon atoms.
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
F2015073Certificate of AnalysisApr 02, 2024 D155934
L2216753Certificate of AnalysisNov 25, 2022 D155934
L2216754Certificate of AnalysisNov 25, 2022 D155934
L2216755Certificate of AnalysisNov 25, 2022 D155934
L2216770Certificate of AnalysisNov 25, 2022 D155934
L2216866Certificate of AnalysisNov 25, 2022 D155934
L2216867Certificate of AnalysisNov 25, 2022 D155934
Chemical and Physical Properties
Boil Point(°C)205 °C/60 mmHg
Melt Point(°C)143 °C
Molecular Weight390.080 g/mol
XLogP33.400
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count16
Rotatable Bond Count7
Exact Mass389.976 Da
Monoisotopic Mass389.976 Da
Topological Polar Surface Area74.600 Ų
Heavy Atom Count24
Formal Charge0
Complexity491.000
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. Mingguo Peng, Yang Xu, Yao Wu, Xuewen Cai, Weihua Zhang, Lu Zheng, Erdeng Du, Jiajun Fu.  (2024)  Binding Affinity and Mechanism of Six PFAS with Human Serum Albumin: Insights from Multi-Spectroscopy, DFT and Molecular Dynamics Approaches.  Toxics,  12  (1): (43).  [PMID:38250999] [10.3390/toxics12010043]
Solution Calculators
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