PACOCF3 - ≥95% , CAS No.141022-99-3

CAS: 141022-99-3 Cat. No.: P275135 Molecular Weight: 308.4 EC Number: 634-260-7 PubChem CID: 4670
AVAILABLE TO ORDER
GRADE & PURITY ≥95%
Synonyms
1,1,1-Trifluoro-2-heptadecanone # | CHEBI:186740 | 1,1,1-Trifluoro-2-heptadecanone | 1,1,1-Trifluoro-heptadecan-2-oneor(Palmitoyl trifluoromethyl ketone (PTK)) | HMS3412D05 | HMS3649G09 | SR-01000597566-2 | HMS3267L18 | DTXSID00274441 | Tocris-1460 | 2-He
Storage
Store at -20°C,Desiccated
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
10mg
P275135-10mg
5
$125.90
25mg
P275135-25mg
5
$197.90
50mg
P275135-50mg
4
$305.90
100mg
P275135-100mg
4
$485.90
250mg
P275135-250mg
3
$971.90
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at -20°C,Desiccated Ships Ice chest + Ice pads 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 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
1, 1, 1-Trifluoro-2-heptadecanone # | CHEBI:186740 | 1, 1, 1-Trifluoro-2-heptadecanone | 1, 1, 1-Trifluoro-heptadecan-2-oneor(Palmitoyl trifluoromethyl ketone (PTK)) | HMS3412D05 | HMS3649G09 | SR-01000597566-2 | HMS3267L18 | DTXSID00274441 | Tocris-1460 | 2-He
Specifications & Purity
≥95%
Biochemical and Physiological Mechanisms
Selective phospholipase A 2 inhibitor (IC 50 = 3.8 μM). Four times more potent than arachidonyl trifluoromethyl ketone . Alters Ca 2+ signaling and impairs memory acquisition and retrieval. Active in vitro .Reversible inhibitor of calcium-dependent phosph
Storage
Store at -20°C, Desiccated
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
INHIBITOR
Note
Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.
Purity
≥95%
Names and Identifiers
Pubchem Sid488179846
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488179846
Canonical SmilesCCCCCCCCCCCCCCCC(=O)C(F)(F)F
IUPAC Name1,1,1-trifluoroheptadecan-2-one
InChIKeyMAHYXYTYTLCTQD-UHFFFAOYSA-N
INCHI1S/C17H31F3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(21)17(18,19)20/h2-15H2,1H3
Isomeric SMILES CCCCCCCCCCCCCCCC(=O)C(F)(F)F
PubChem CID 4670
Molecular Weight 308.4

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
SuperclassOrganic oxygen compounds
ClassOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones
Direct ParentAlpha-haloketones
Alternative Parents Organofluorides  Organic oxides  Hydrocarbon derivatives  Alkyl fluorides  
Molecular FrameworkAliphatic acyclic compounds
Substituents Alpha-haloketone - Organic oxide - Hydrocarbon derivative - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as alpha-haloketones. These are organic compounds contaning a halogen atom attached to the alpha carbon atom relative to C=O group.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
LPL Tchem Lipoprotein lipase (101 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PLA2G4A Tchem Cytosolic phospholipase A2 (785 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2D6 Tclin Cytochrome P450 2D6 (33882 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PLA2G6 Tchem Calcium-independent phospholipase A2 (359 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP1A2 Tchem Cytochrome P450 1A2 (26471 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
PLA2G5 Tchem Phospholipase A2 group V (238 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2C9 Tchem Cytochrome P450 2C9 (32119 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP2C19 Tchem Cytochrome P450 2C19 (29246 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HSD17B10 Tchem Endoplasmic reticulum-associated amyloid beta-peptide-binding protein (20669 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
LIPG Tchem Endothelial lipase (1021 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
USP1 Tchem Ubiquitin carboxyl-terminal hydrolase 1 (22556 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MEN1 Tchem Menin/Histone-lysine N-methyltransferase MLL (48157 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Hdac6 Histone deacetylase 6 (222 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
lef Anthrax lethal factor (7585 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
rep Replicase polyprotein 1ab (378 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.

10 results found

Lot NumberCertificate TypeDateItem
C23161490Certificate of AnalysisApr 03, 2026 P275135
C23161492Certificate of AnalysisApr 03, 2026 P275135
C23161502Certificate of AnalysisApr 03, 2026 P275135
C23161515Certificate of AnalysisApr 03, 2026 P275135
C2317018Certificate of AnalysisApr 03, 2026 P275135
C2317031Certificate of AnalysisApr 03, 2026 P275135
C23161471Certificate of AnalysisMar 18, 2026 P275135
C23161481Certificate of AnalysisMar 18, 2026 P275135
C23161491Certificate of AnalysisMar 18, 2026 P275135
C23161493Certificate of AnalysisMar 18, 2026 P275135
Chemical and Physical Properties
SolubilitySoluble in DMSO to 25 mM and in ethanol to 50 mM
Molecular Weight308.400 g/mol
XLogP38.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count14
Exact Mass308.233 Da
Monoisotopic Mass308.233 Da
Topological Polar Surface Area17.100 Ų
Heavy Atom Count21
Formal Charge0
Complexity249.000
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
Reviews

Customer Reviews

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