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Hexadecylbenzene - >99.0%(GC), high purity , CAS No.1459-09-2

COA

Grade & Purity:

≥99%(GC)

Cas Number: 1459-09-2
Molecular Weight: 302.55
Beilstein Registry Number: 5(4)1216
MDL number: MFCD00039871
PubChem CID: 15085
PubChem SID: 488182062

In stock

Item Number

H157146

Grouped product items
SKU	Size	Availability	Price
H157146-1g	1g	≥10	$27.90
H157146-5g	5g	3	$106.90
H157146-25g	25g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$319.90

View related series

aromatic hydrocarbon (251) Non heterocyclic block (8163)

Basic Description

Synonyms	Cetylbenzene \| SY053362 \| Hexadecylbenzene \| Phenyl hexadecane \| LS-14971 \| Benzene, hexadecyl- \| UNII-39HL93NE0R \| Hexadecane, 1-phenyl- \| EINECS 215-949-8 \| n-HEXADECYL BENZENE \| FT-0633561 \| DTXSID4061707 \| AKOS024319388 \| N-HEXADECYLBENZENE \| 39HL93NE
Specifications & Purity	≥99%(GC)
Shipped In	Normal

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	488182062
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488182062
IUPAC Name	hexadecylbenzene
INCHI	InChI=1S/C22H38/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-20-17-15-18-21-22/h15,17-18,20-21H,2-14,16,19H2,1H3
InChIKey	DEQLTFPCJRGSHW-UHFFFAOYSA-N
Smiles	CCCCCCCCCCCCCCCCC1=CC=CC=C1
Isomeric SMILES	CCCCCCCCCCCCCCCCC1=CC=CC=C1
Molecular Weight	302.55
Beilstein	5(4)1216
Reaxy-Rn	1957737
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1957737&ln=

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
A2008035	Certificate of Analysis	Oct 07, 2023	H157146
L2219038	Certificate of Analysis	Jan 06, 2023	H157146
J2225146	Certificate of Analysis	Nov 10, 2022	H157146

Chemical and Physical Properties

Refractive Index	1.48
Boil Point(°C)	172 °C/1 mmHg
Melt Point(°C)	25 °C
Molecular Weight	302.500 g/mol
XLogP3	10.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	15
Exact Mass	302.297 Da
Monoisotopic Mass	302.297 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	202.000
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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