Cyclobutyl Phenyl Ketone - ≥95%(GC) , CAS No.5407-98-7

CAS: 5407-98-7 Cat. No.: C153782 Molecular Weight: 160.22 Beilstein Registry Number: 7374
AVAILABLE TO ORDER
GRADE & PURITY ≥95%(GC)
Synonyms
DTXCID9028176 | EN300-82990 | Cyclobutyl phenyl ketone, 98% | NCGC00257510-01 | phenyl cyclobutyl ketone | CAS-5407-98-7 | Cyclobutyl(phenyl)methanone | cyclobutyl-phenyl-methanone | FT-0624157 | AKOS009156391 | EINECS 226-473-5 | 3,4-(Methylenedioxy)benz
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
C153782-1g
3
$14.90
5g
C153782-5g
2
$57.90
25g
C153782-25g
1
$256.90
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Why this grade

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

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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.

Overview

Cyclobutyl phenyl ketone was used to study thermal reactions of parent and phenyl substituted N-acyl cyclobutylimines.

Specifications

Synonyms
DTXCID9028176 | EN300-82990 | Cyclobutyl phenyl ketone, 98% | NCGC00257510-01 | phenyl cyclobutyl ketone | CAS-5407-98-7 | Cyclobutyl(phenyl)methanone | cyclobutyl-phenyl-methanone | FT-0624157 | AKOS009156391 | EINECS 226-473-5 | 3, 4-(Methylenedioxy)benz
Specifications & Purity
≥95%(GC)
Storage
Room temperature
Shipped In
Normal
Purity
≥95%(GC)
Names and Identifiers
Pubchem Sid504755371
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504755371
Canonical SmilesC1CC(C1)C(=O)C2=CC=CC=C2
IUPAC Namecyclobutyl(phenyl)methanone
InChIKeyMVEBDOSCXOQNAR-UHFFFAOYSA-N
INCHI1S/C11H12O/c12-11(10-7-4-8-10)9-5-2-1-3-6-9/h1-3,5-6,10H,4,7-8H2
Isomeric SMILES C1CC(C1)C(=O)C2=CC=CC=C2
WGK Germany 3
Molecular Weight 160.22
Beilstein 7374
Reaxy-Rn 2044307
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2044307&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.

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🔬 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 - Aryl ketones - Phenylketones
Direct ParentAlkyl-phenylketones
Alternative Parents Benzoyl derivatives  Aryl alkyl ketones  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Alkyl-phenylketone - Aryl alkyl ketone - Benzoyl - Benzenoid - Monocyclic benzene moiety - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
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
H2401380Certificate of AnalysisApr 16, 2024 C153782
F2419211Certificate of AnalysisMar 27, 2024 C153782
F2419212Certificate of AnalysisMar 27, 2024 C153782
F2419213Certificate of AnalysisMar 27, 2024 C153782
F2419229Certificate of AnalysisMar 27, 2024 C153782
F2419230Certificate of AnalysisMar 27, 2024 C153782
F2419231Certificate of AnalysisMar 27, 2024 C153782
Chemical and Physical Properties
Refractive Index1.55
Flash Point(°F)>235.4 °F
Flash Point(°C)>113 °C
Boil Point(°C)115 °C/6.8 mmHg
Melt Point(°C)116℃
Molecular Weight160.210 g/mol
XLogP32.600
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count2
Exact Mass160.089 Da
Monoisotopic Mass160.089 Da
Topological Polar Surface Area17.100 Ų
Heavy Atom Count12
Formal Charge0
Complexity164.000
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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