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Octatriacontane - >96.0%, high purity , CAS No.7194-85-6

COA

Grade & Purity:

≥96%

Cas Number: 7194-85-6
Molecular Weight: 535.04
Beilstein Registry Number: 1713500
MDL number: MFCD00042899
PubChem CID: 23599

In stock

Item Number

O160002

Grouped product items
SKU	Size	Availability	Price	Qty
O160002-200mg	200mg	3	$23.90

Basic Description

Synonyms	DTXSID5064592 \| 9F9P0JAC5W \| Q151204 \| LS-15413 \| O0110 \| Octatriacontane, >=95.0% (GC) \| Octatriacontane \| Octatriacontane; n-Octatriacontane \| UNII-9F9P0JAC5W \| AI3-36495 \| N-OCTATRIACONTANE \| EINECS 230-560-3 \| MFCD00042899 \| n-Octatriacontane 100 micr
Specifications & Purity	≥96%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Hydrocarbons
  - Class Saturated hydrocarbons
    - Subclass Alkanes

Kingdom	Organic compounds
Superclass	Hydrocarbons
Class	Saturated hydrocarbons
Subclass	Alkanes
Intermediate Tree Nodes	Not available
Direct Parent	Alkanes
Alternative Parents	Not available
Molecular Framework	Aliphatic acyclic compounds
Substituents	Acyclic alkane - Alkane - Aliphatic acyclic compound
Description	This 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	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	octatriacontane
INCHI	InChI=1S/C38H78/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-38H2,1-2H3
InChIKey	BVKCQBBZBGYNOP-UHFFFAOYSA-N
Smiles	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
Isomeric SMILES	CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
WGK Germany	3
Molecular Weight	535.04
Beilstein	1713500
Reaxy-Rn	1713496
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1713496&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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2 results found

Lot Number	Certificate Type	Date	Item
L2008016	Certificate of Analysis	Sep 14, 2024	O160002
C2209255	Certificate of Analysis	Mar 15, 2022	O160002

Chemical and Physical Properties

Melt Point(°C)	79 °C
Molecular Weight	535.000 g/mol
XLogP3	20.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	35
Exact Mass	534.61 Da
Monoisotopic Mass	534.61 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	38
Formal Charge	0
Complexity	336.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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