3-Acetylphenanthrene - technical grade, ≥90% , CAS No.2039-76-1

CAS: 2039-76-1 Cat. No.: A138450 Molecular Weight: 220.27 EC Number: 218-020-5
AVAILABLE TO ORDER
GRADE & PURITY Technical grade ? Technical grade — industrial-quality purity with no tight impurity guarantees. Use for large-scale or non-critical processes where cost matters most. ≥90%
Synonyms
EINECS 218-020-5 | DTXSID9049243 | 3-Acetylphenanthrene | AKOS004908916 | Ethanone, 1-(3-phenanthrenyl)- | SCHEMBL50671 | 4-Bromobutene | 00W4083OML | ACETOPROPYLACETATE | DTXCID1029099 | Methyl 3-phenanthryl ketone | 1-(3-Phenanthryl)ethanone # | FD10623
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
250mg
A138450-250mg
4

$30.90

$46.90
Save $16.00 (34.12%)
1g
A138450-1g
9

$75.90

$113.90
Save $38.00 (33.36%)
5g
A138450-5g
10

$214.90

$322.90
Save $108.00 (33.45%)
25g
A138450-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$805.90

$1,208.90
Save $403.00 (33.34%)
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Why this grade

technical grade, ≥90% Technical grade 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.

Specifications

Synonyms
EINECS 218-020-5 | DTXSID9049243 | 3-Acetylphenanthrene | AKOS004908916 | Ethanone, 1-(3-phenanthrenyl)- | SCHEMBL50671 | 4-Bromobutene | 00W4083OML | ACETOPROPYLACETATE | DTXCID1029099 | Methyl 3-phenanthryl ketone | 1-(3-Phenanthryl)ethanone # | FD10623
Specifications & Purity
technical grade, ≥90%
Storage
Room temperature
Shipped In
Normal
Grade
Technical grade
Purity
≥90%
Names and Identifiers
Pubchem Sid488184993
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488184993
Canonical SmilesCC(=O)C1=CC2=C(C=CC3=CC=CC=C32)C=C1
IUPAC Name1-phenanthren-3-ylethanone
InChIKeyJKVNPRNAHRHQDD-UHFFFAOYSA-N
INCHI1S/C16H12O/c1-11(17)14-9-8-13-7-6-12-4-2-3-5-15(12)16(13)10-14/h2-10H,1H3
Isomeric SMILES CC(=O)C1=CC2=C(C=CC3=CC=CC=C32)C=C1
WGK Germany 3
Molecular Weight 220.27
Reaxy-Rn 2329395
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2329395&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
SuperclassBenzenoids
ClassPhenanthrenes and derivatives
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentPhenanthrenes and derivatives
Alternative Parents Naphthalenes  Acetophenones  Aryl alkyl ketones  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homopolycyclic compounds
Substituents Phenanthrene - Naphthalene - Acetophenone - Aryl alkyl ketone - Aryl ketone - Ketone - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homopolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as phenanthrenes and derivatives. These are polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused benzene.
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.

10 results found

Lot NumberCertificate TypeDateItem
H2201066Certificate of AnalysisFeb 04, 2026 A138450
H2201069Certificate of AnalysisFeb 04, 2026 A138450
C2519342Certificate of AnalysisMar 27, 2025 A138450
E2315419Certificate of AnalysisFeb 11, 2025 A138450
E2315414Certificate of AnalysisFeb 11, 2025 A138450
E2315408Certificate of AnalysisAug 08, 2022 A138450
I2017115Certificate of AnalysisJul 21, 2022 A138450
I2017114Certificate of AnalysisJul 21, 2022 A138450
I2227095Certificate of AnalysisJul 19, 2022 A138450
I2227096Certificate of AnalysisJul 19, 2022 A138450
Chemical and Physical Properties
Melt Point(°C)67-71°C
Molecular Weight220.260 g/mol
XLogP34.100
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass220.089 Da
Monoisotopic Mass220.089 Da
Topological Polar Surface Area17.100 Ų
Heavy Atom Count17
Formal Charge0
Complexity296.000
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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