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1-Bromo-3,7,11,15-tetramethylhexadecane - 95%, high purity , CAS No.2791-57-3

COA

Grade & Purity:

≥95%

Cas Number: 2791-57-3
Molecular Weight: 361.45
MDL number: MFCD31580049
PubChem CID: 10808570

In stock

Item Number

B405446

Grouped product items
SKU	Size	Availability	Price
B405446-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$136.90
B405446-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$198.90
B405446-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$599.90

View related series

Haloalkane (186)

Basic Description

Synonyms	DNKBEUKCVDMKFH-UHFFFAOYSA-N \| B6206 \| Phytanyl Bromide \| Dihydrophytylbromid \| 1-bromo-3,7,11,15-tetramethylhexadecane \| SCHEMBL95650 \| DTXSID40445234 \| Hexadecane, 1-bromo-3,7,11,15-tetramethyl- \| MFCD31580049
Specifications & Purity	≥95%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Lipids and lipid-like molecules
  - Class Prenol lipids
    - Subclass Diterpenoids

Kingdom	Organic compounds
Superclass	Lipids and lipid-like molecules
Class	Prenol lipids
Subclass	Diterpenoids
Intermediate Tree Nodes	Not available
Direct Parent	Acyclic diterpenoids
Alternative Parents	Organobromides Hydrocarbon derivatives Alkyl bromides
Molecular Framework	Aliphatic acyclic compounds
Substituents	Acyclic diterpenoid - Hydrocarbon derivative - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as acyclic diterpenoids. These are diterpenoids (compounds made of four consecutive isoprene units) that do not contain a cycle.
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	1-bromo-3,7,11,15-tetramethylhexadecane
INCHI	InChI=1S/C20H41Br/c1-17(2)9-6-10-18(3)11-7-12-19(4)13-8-14-20(5)15-16-21/h17-20H,6-16H2,1-5H3
InChIKey	DNKBEUKCVDMKFH-UHFFFAOYSA-N
Smiles	CC(C)CCCC(C)CCCC(C)CCCC(C)CCBr
Isomeric SMILES	CC(C)CCCC(C)CCCC(C)CCCC(C)CCBr
Molecular Weight	361.45
Reaxy-Rn	1763561
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1763561&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Refractive Index	1.46
Flash Point(°C)	145 °C
Boil Point(°C)	156 °C/0.1 mmHg
Molecular Weight	361.400 g/mol
XLogP3	9.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	14
Exact Mass	360.239 Da
Monoisotopic Mass	360.239 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	21
Formal Charge	0
Complexity	212.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	3
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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