Chrysene - ≥97% , CAS No.218-01-9

CAS: 218-01-9 Cat. No.: C107020 Molecular Weight: 228.29 Beilstein Registry Number: 1909297 EC Number: 205-923-4
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
Chrysen | FT-0623810 | AI3-00867 | AKOS015904682 | AS-39344 | Benzo[a]phenanthrene (purified by sublimation) | Chrysene 10 microg/mL in Cyclohexane | Chrysene, analytical standard | Coal tar pitch volatiles: chrysene | NCGC00260097-01 | CHRYSENE [IARC] |
Storage
Room temperature
Shipped In
Normal
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Size
Status
Price
Qty
100mg
C107020-100mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$39.90
250mg
C107020-250mg
3
$70.90
1g
C107020-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
$167.90
5g
C107020-5g
1
$672.90
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Why this grade

≥97% 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 34 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
Chrysen | FT-0623810 | AI3-00867 | AKOS015904682 | AS-39344 | Benzo[a]phenanthrene (purified by sublimation) | Chrysene 10 microg/mL in Cyclohexane | Chrysene, analytical standard | Coal tar pitch volatiles: chrysene | NCGC00260097-01 | CHRYSENE [IARC] |
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Pubchem Sid504751796
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504751796
Canonical SmilesC1=CC=C2C(=C1)C=CC3=C2C=CC4=CC=CC=C43
IUPAC Namechrysene
InChIKeyWDECIBYCCFPHNR-UHFFFAOYSA-N
INCHI1S/C18H12/c1-3-7-15-13(5-1)9-11-18-16-8-4-2-6-14(16)10-12-17(15)18/h1-12H
Isomeric SMILES C1=CC=C2C(=C1)C=CC3=C2C=CC4=CC=CC=C43
WGK Germany 3
RTECS GC0700000
UN Number 3077
Packing Group III
Molecular Weight 228.29
Beilstein 1909297
Reaxy-Rn 1909297
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1909297&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
SuperclassBenzenoids
ClassPhenanthrenes and derivatives
SubclassChrysenes
Intermediate Tree Nodes Not available
Direct ParentChrysenes
Alternative Parents Naphthalenes  Aromatic hydrocarbons  Polycyclic hydrocarbons  Unsaturated hydrocarbons  
Molecular FrameworkAromatic homopolycyclic compounds
Substituents Chrysene - Naphthalene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homopolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as chrysenes. These are compounds containing the polyaromatic chrysene moiety, which consists of a benzene ring fused to a phenanthrene ring system to form Benzo[a]phenanthrene.
External Descriptors an aromatic compound
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
HPRT1 Tchem Hypoxanthine-guanine phosphoribosyltransferase (369 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
AHR Tclin Aryl hydrocarbon receptor (1071 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Polycyclic aromatic hydrocarbon binding protein (16 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 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.

12 results found

Lot NumberCertificate TypeDateItem
G2220442Certificate of AnalysisMay 09, 2026 C107020
G2220444Certificate of AnalysisMay 09, 2026 C107020
D2603125Certificate of AnalysisApr 14, 2026 C107020
K2113347Certificate of AnalysisAug 13, 2025 C107020
F2121087Certificate of AnalysisApr 03, 2025 C107020
F2121089Certificate of AnalysisApr 03, 2025 C107020
F2425144Certificate of AnalysisApr 02, 2024 C107020
E2523070Certificate of AnalysisJun 11, 2022 C107020
G2220443Certificate of AnalysisJun 11, 2022 C107020
H2511033Certificate of AnalysisJun 11, 2022 C107020
J2430180Certificate of AnalysisJun 11, 2022 C107020
K2427159Certificate of AnalysisJun 11, 2022 C107020

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Chemical and Physical Properties
SolubilityInsoluble in water, extremely slightly soluble in alcohol and ether.
Boil Point(°C)448°C
Melt Point(°C)246-256°C
Molecular Weight228.300 g/mol
XLogP35.700
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass228.094 Da
Monoisotopic Mass228.094 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count18
Formal Charge0
Complexity264.000
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
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14. Lige Zhang, Xiaoyu Qiu, Ling Huang, Jijun Xu, Weiwei Wang, Zhao Li, Ping Xu, Hongzhi Tang.  (2021)  Microbial degradation of multiple PAHs by a microbial consortium and its application on contaminated wastewater.  JOURNAL OF HAZARDOUS MATERIALS,      [PMID:34323721] [10.1016/j.jhazmat.2021.126524]
15. Yue Lin, Xiu Huang, Yongchun Liu, Dong Cao, Dawei Lu, Zeming Feng, Qian Liu, Zhenyu Lin, Guibin Jiang.  (2021)  Identification, Quantification, and Imaging of the Biodistribution of Soot Particles by Mass Spectral Fingerprinting.  ANALYTICAL CHEMISTRY,      [PMID:33881821] [10.1021/acs.analchem.0c05180]
16. Chen Yang, Huang Ailan, Zhang Lu, Bie Zijun.  (2020)  Crystalline MOF nanofilm-based SALDI-MS array for determination of small molecules.  MICROCHIMICA ACTA,  187  (6): (1-9).  [PMID:32399782] [10.1007/s00604-020-04310-x]
17. Ning Zhang, Lishen Su, Suning Man, Xiaoyun Lei, Ting Huang, Chunling Zhu, Lan Zhang, Xiaoping Wu.  (2019)  Task-specific solid-phase microextraction based on ionic liquid/polyhedral oligomeric silsesquioxane hybrid coating for sensitive analysis of polycyclic aromatic hydrocarbons by gas chromatography–mass spectrometry.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:30954244] [10.1016/j.chroma.2019.03.062]
18. Xiao Sun, Jing Li, Li Xu.  (2018)  Synthesis of penetrable poly(methacrylic acid-co-ethylene glycol dimethacrylate) microsphere and its HPLC application in protein separation.  TALANTA,      [PMID:29759187] [10.1016/j.talanta.2018.03.080]
19. Liu Wei, Quan Ji.  (2018)  Prediction of Dispersive Liquid–Liquid Microextraction Enrichment Effect of Aromatic Organics by [OMIM] [PF6] Ionic Liquid Based on Atom-Type Electrotopological State Indices.  CHROMATOGRAPHIA,  81  (4): (595-610).  [PMID:] [10.1007/s10337-018-3492-6]
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