Butyl perfluorooctanoate - ≥98% , CAS No.307-96-0

CAS: 307-96-0 Cat. No.: B357033 Molecular Weight: 470.17
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
Butyl perfluorooctanoate | Butyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanoate | DTXSID20895738 | n-Butyl perfluorooctanoate | n-Butyl perfluorooctanoate, 92% | Pentadecafluorooctanoic acid, butyl ester | FT-0631931 | SCHEMBL10349692 | Butyl pent
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
B357033-1g
5

$74.90

$86.90
Save $12.00 (13.81%)
5g
B357033-5g
5
$299.90
25g
B357033-25g
5

$714.90

$833.90
Save $119.00 (14.27%)
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.

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Literature proof

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

Specifications

Synonyms
Butyl perfluorooctanoate | Butyl 2, 2, 3, 3, 4, 4, 5, 5, 6, 6, 7, 7, 8, 8, 8-pentadecafluorooctanoate | DTXSID20895738 | n-Butyl perfluorooctanoate | n-Butyl perfluorooctanoate, 92% | Pentadecafluorooctanoic acid, butyl ester | FT-0631931 | SCHEMBL10349692 | Butyl pent
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid488193799
Canonical SmilesCCCCOC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
IUPAC Namebutyl 2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-pentadecafluorooctanoate
InChIKeySBMFZWPPSPRLTN-UHFFFAOYSA-N
INCHI1S/C12H9F15O2/c1-2-3-4-29-5(28)6(13,14)7(15,16)8(17,18)9(19,20)10(21,22)11(23,24)12(25,26)27/h2-4H2,1H3
Isomeric SMILES CCCCOC(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
Molecular Weight 470.17
Reaxy-Rn 1810253
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1810253&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 fluorides
Intermediate Tree Nodes Not available
Direct ParentPerfluoroalkyl carboxylic acid and derivatives
Alternative Parents Fatty acid esters  Alpha-halocarboxylic acid derivatives  Carboxylic acid esters  Monocarboxylic acids and derivatives  Organofluorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAliphatic acyclic compounds
Substituents Perfluoroalkyl carboxylic acid or derivatives - Fatty acid ester - Fatty acyl - Alpha-halocarboxylic acid or derivatives - Alpha-halocarboxylic acid derivative - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Carbonyl group - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as perfluoroalkyl carboxylic acid and derivatives. These are organic compounds containing an alkyl chain attached to the C-alpha of a carboxylic acid group (or a derivative thereof), where all hydrogens of the alkyl chain are replaced by fluorine 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.

6 results found

Lot NumberCertificate TypeDateItem
G2326289Certificate of AnalysisMay 09, 2026 B357033
G2326296Certificate of AnalysisMay 09, 2026 B357033
G2326298Certificate of AnalysisMay 09, 2026 B357033
G2326308Certificate of AnalysisMay 09, 2026 B357033
G2326347Certificate of AnalysisMay 09, 2026 B357033
G2326351Certificate of AnalysisMay 09, 2026 B357033
Chemical and Physical Properties
Molecular Weight470.170 g/mol
XLogP36.500
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count17
Rotatable Bond Count10
Exact Mass470.036 Da
Monoisotopic Mass470.036 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count29
Formal Charge0
Complexity593.000
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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