Dotriacontane - ≥96% , CAS No.544-85-4

CAS: 544-85-4 Cat. No.: D104741 Molecular Weight: 450.87 Beilstein Registry Number: 1783260 EC Number: 208-881-5
AVAILABLE TO ORDER
GRADE & PURITY ≥96%
Synonyms
Bicetyl | CH3-(CH2)30-CH3 | LMFA11000570 | n-Dotriacontane 100 microg/mL in n-Hexane | Dotriacontane, analytical standard | FT-0625591 | Dotriacontane, n- | M01641 | EINECS 208-881-5 | NSC 6361 | CH3-[CH2]30-CH3 | NSC6361 | NSC-6361 | D0998 | D89756 | WLN
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
D104741-1g
3
$9.90
5g
D104741-5g
5
$24.90
25g
D104741-25g
3
$84.90
Enter a quantity for the sizes you want to add.
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Why this grade

≥96% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
Bicetyl | CH3-(CH2)30-CH3 | LMFA11000570 | n-Dotriacontane 100 microg/mL in n-Hexane | Dotriacontane, analytical standard | FT-0625591 | Dotriacontane, n- | M01641 | EINECS 208-881-5 | NSC 6361 | CH3-[CH2]30-CH3 | NSC6361 | NSC-6361 | D0998 | D89756 | WLN
Specifications & Purity
≥96%
Storage
Room temperature
Shipped In
Normal
Purity
≥96%
Names and Identifiers
Canonical SmilesCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
IUPAC Namedotriacontane
InChIKeyQHMGJGNTMQDRQA-UHFFFAOYSA-N
INCHI1S/C32H66/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-32H2,1-2H3
Isomeric SMILES CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
WGK Germany 3
RTECS JT2360000
Molecular Weight 450.87
Beilstein 1783260
Reaxy-Rn 1783260
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1783260&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
SuperclassHydrocarbons
ClassSaturated hydrocarbons
SubclassAlkanes
Intermediate Tree Nodes Not available
Direct ParentAlkanes
Alternative Parents Not available
Molecular FrameworkAliphatic acyclic compounds
Substituents Acyclic alkane - Alkane - Aliphatic acyclic compound
DescriptionThis compound belongs to the class of organic compounds known as alkanes. These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2 , and therefore consisting entirely of hydrogen atoms and saturated carbon atoms.
External Descriptors Hydrocarbons
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.

14 results found

Lot NumberCertificate TypeDateItem
K2120440Certificate of AnalysisSep 04, 2025 D104741
H2508266Certificate of AnalysisAug 19, 2025 D104741
H2508332Certificate of AnalysisAug 19, 2025 D104741
F2101137Certificate of AnalysisMar 04, 2025 D104741
K2414111Certificate of AnalysisNov 21, 2024 D104741
J2428250Certificate of AnalysisOct 31, 2024 D104741
G2431193Certificate of AnalysisAug 14, 2024 D104741
G2431195Certificate of AnalysisAug 14, 2024 D104741
D2014095Certificate of AnalysisFeb 19, 2024 D104741
H2322020Certificate of AnalysisAug 28, 2023 D104741
E2304499Certificate of AnalysisMay 17, 2023 D104741
F2316983Certificate of AnalysisMay 17, 2023 D104741
E1922102Certificate of AnalysisMar 09, 2023 D104741
L2219054Certificate of AnalysisDec 23, 2022 D104741

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Chemical and Physical Properties
Refractive Index1.455
Boil Point(°C)467°C
Melt Point(°C)69.7°C
Molecular Weight450.900 g/mol
XLogP316.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count29
Exact Mass450.516 Da
Monoisotopic Mass450.516 Da
Topological Polar Surface Area0.000 Ų
Heavy Atom Count32
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
1. Xinxin He, Xiaoya Liu, Jun Tang, Haifeng Dong, Yasuhiro Sugawara, Yan Jun Li, Zongmin Ma, Jun Liu.  (2023)  Effect of Preparation Processes on Structural Thermal Stability and Collision Energy Dissipation of Common Antirelaxation Coatings on Quartz Substrates.  LANGMUIR,      [PMID:37651224] [10.1021/acs.langmuir.3c01480]
2. Qing Du, Xin Shang, Yangyang Yuan, Xiong Su, Yanqiang Huang.  (2025)  Hydrocracking of Polyethylene to Gasoline-Range Hydrocarbons over a Ruthenium-Zeolite Bifunctional Catalyst System with Optimal Synergy of Metal and Acid Sites.  Catalysts,  15  (4): (335).  [PMID:] [10.3390/catal15040335]
Solution Calculators
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