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Tridecylbenzene - >99.0%(GC), high purity , CAS No.123-02-4

COA

Grade & Purity:

≥99%(GC)

Cas Number: 123-02-4
Molecular Weight: 260.47
Beilstein Registry Number: 1947200
MDL number: MFCD00008980
PubChem CID: 31238
PubChem SID: 488183143

In stock

Item Number

T162081

Grouped product items
SKU	Size	Availability	Price
T162081-1ml	1ml	2	$12.90
T162081-5ml	5ml	2	$49.90
T162081-25ml	25ml	4	$222.90

View related series

aromatic hydrocarbon (251) Non heterocyclic block (8163)

Basic Description

Synonyms	EINECS 204-592-3 \| NCGC00164040-01 \| EINECS 272-008-4 \| Tridecane, 1-phenyl- \| Tridecane, phenyl- \| HSDB 5173 \| Phenyltridecane \| MFCD00008980 \| UNII-E6K14656YO \| Tox21_303706 \| 1-Phenyltridecane \| CP 98576 \| T0419 \| TRIDECYLBENZENE \| n-Tridecylbenzene \|
Specifications & Purity	≥99%(GC)
Shipped In	Normal
Product Description	1-phenyltridecane was converted to trans-cinnamic and 3-phenylpropionic acid by an oil-degrading bacterium.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzene and substituted derivatives
Alternative Parents	Aromatic hydrocarbons Unsaturated hydrocarbons
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Monocyclic benzene moiety - Aromatic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
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

Pubchem Sid	488183143
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488183143
IUPAC Name	tridecylbenzene
INCHI	InChI=1S/C19H32/c1-2-3-4-5-6-7-8-9-10-11-13-16-19-17-14-12-15-18-19/h12,14-15,17-18H,2-11,13,16H2,1H3
InChIKey	MCVUKOYZUCWLQQ-UHFFFAOYSA-N
Smiles	CCCCCCCCCCCCCC1=CC=CC=C1
Isomeric SMILES	CCCCCCCCCCCCCC1=CC=CC=C1
WGK Germany	1
PubChem CID	31238
Molecular Weight	260.47
Beilstein	1947200
Reaxy-Rn	1947201

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.

3 results found

Lot Number	Certificate Type	Date	Item
J2211345	Certificate of Analysis	Sep 20, 2022	T162081
J2211344	Certificate of Analysis	Sep 20, 2022	T162081
J2211346	Certificate of Analysis	Sep 20, 2022	T162081

Chemical and Physical Properties

Refractive Index	1.48
Flash Point(°F)	>233.6 °F
Flash Point(°C)	112 °C
Boil Point(°C)	346 °C
Melt Point(°C)	10 °C
Molecular Weight	260.500 g/mol
XLogP3	9.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	12
Exact Mass	260.25 Da
Monoisotopic Mass	260.25 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	167.000
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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