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Decahydronaphthalene-d₁₈ - 98% , 99 Atom% D, Cis–trans isomerism mixture, high purity , CAS No.28788-42-3

COA

Grade & Purity:

≥99 atom% D,≥98%
mixture of Cis–trans isomers

Cas Number: 28788-42-3
Molecular Weight: 156.36
MDL number: MFCD00044371
PubChem CID: 2724146

In stock

Item Number

D118378

Grouped product items
SKU	Size	Availability	Price	Qty
D118378-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$43.90
D118378-1g	1g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$137.90

Basic Description

Synonyms	Decalin-d18 \| Decahydronaphthalene-d18, 98 atom % D \| cis-Decahydronaphthalene-d18 \| d18-cis-decahydronaphthalene \| J-017260 \| 1,1,2,2,3,3,4,4,4a,5,5,6,6,7,7,8,8,8a-octadecadeuterionaphthalene \| Decahydronaphthalene-d18 \| AKOS015903083 \| D98696 \| Decahydr
Specifications & Purity	≥99 atom% D,≥98%, mixture of Cis–trans isomers
Storage Temp	Protected from light
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Hydrocarbons
  - Class Polycyclic hydrocarbons

Kingdom	Organic compounds
Superclass	Hydrocarbons
Class	Polycyclic hydrocarbons
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Polycyclic hydrocarbons
Alternative Parents	Saturated hydrocarbons
Molecular Framework	Aliphatic homopolycyclic compounds
Substituents	Polycyclic hydrocarbon - Saturated hydrocarbon - Aliphatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as polycyclic hydrocarbons. These are polycyclic organic compounds made up only of carbon and hydrogen 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	1,1,2,2,3,3,4,4,4a,5,5,6,6,7,7,8,8,8a-octadecadeuterionaphthalene
INCHI	InChI=1S/C10H18/c1-2-6-10-8-4-3-7-9(10)5-1/h9-10H,1-8H2/i1D2,2D2,3D2,4D2,5D2,6D2,7D2,8D2,9D,10D
InChIKey	NNBZCPXTIHJBJL-XRRAJICISA-N
Smiles	C1CCC2CCCCC2C1
Isomeric SMILES	[2H]C1(C(C(C2(C(C(C(C(C2(C1([2H])[2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])[2H])([2H])[2H])([2H])[2H])[2H]
WGK Germany	3
UN Number	1147
Molecular Weight	156.36
Reaxy-Rn	878165
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=878165&ln=

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

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Analytical Chart:

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Lot Number	Certificate Type	Date	Item
G2328097	Certificate of Analysis	Jul 20, 2023	D118378

Chemical and Physical Properties

Sensitivity	Light sensitive；Moisture sensitive
Refractive Index	1.475
Flash Point(°F)	57°C
Flash Point(°C)	57°C
Boil Point(°C)	193°C
Molecular Weight	156.360 g/mol
XLogP3	4.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	156.254 Da
Monoisotopic Mass	156.254 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	80.600
Isotope Atom Count	18
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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