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Benz[a]anthracene-d₁₂ - 99%，98 atom % D, high purity , CAS No.1718-53-2

COA

Grade & Purity:

≥98 atom% D,≥99%

Cas Number: 1718-53-2
Molecular Weight: 240.36
MDL number: MFCD00142458
PubChem CID: 12279531

In stock

Item Number

B471948

Grouped product items
SKU	Size	Availability	Price
B471948-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$24.90
B471948-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$73.90
B471948-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$207.90
B471948-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$399.90
B471948-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$999.90

Basic Description

Synonyms	AKOS015903794 \| Benz[a]anthracene-d12, 98 atom % D \| Benz[a]anthracene D12 10 microg/mL in Acetonitrile \| D99428 \| BAA71853 \| Benz[a]anthracene D12 \| Tetraphene-d12 \| Benz[a]anthracene D12 10 microg/mL in Cyclohexane \| (?H??)tetraphene \| J-010767 \| BENZO(
Specifications & Purity	≥98 atom% D,≥99%
Storage Temp	Store at 2-8°C,Argon charged
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 Benzenoids
  - Class Phenanthrenes and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenanthrenes and derivatives
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Phenanthrenes and derivatives
Alternative Parents	Anthracenes Aromatic hydrocarbons Polycyclic hydrocarbons Unsaturated hydrocarbons
Molecular Framework	Aromatic homopolycyclic compounds
Substituents	Phenanthrene - Anthracene - Aromatic hydrocarbon - Polycyclic hydrocarbon - Unsaturated hydrocarbon - Hydrocarbon - Aromatic homopolycyclic compound
Description	This compound belongs to the class of organic compounds known as phenanthrenes and derivatives. These are polycyclic compounds containing a phenanthrene moiety, which is a tricyclic aromatic compound with three non-linearly fused 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

IUPAC Name	1,2,3,4,5,6,7,8,9,10,11,12-dodecadeuteriobenzo[a]anthracene
INCHI	InChI=1S/C18H12/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-12H/i1D,2D,3D,4D,5D,6D,7D,8D,9D,10D,11D,12D
InChIKey	DXBHBZVCASKNBY-AQZSQYOVSA-N
Smiles	[2H]c1c([2H])c([2H])c2c(c1[2H])c([2H])c([2H])c3c([2H])c4c([2H])c([2H])c([2H])c([2H])c4c([2H])c23
Isomeric SMILES	[2H]C1=C(C(=C2C(=C1[2H])C(=C(C3=C(C4=C(C(=C(C(=C4C(=C32)[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H])[2H]
WGK Germany	2
Alternate CAS	56-55-3（unlabelled）
UN Number	2811
Molecular Weight	240.36
Reaxy-Rn	1909298
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1909298&ln=

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

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6 results found

Lot Number	Certificate Type	Date	Item
E2513138	Certificate of Analysis	Apr 23, 2025	B471948
E2513139	Certificate of Analysis	Apr 23, 2025	B471948
E2513141	Certificate of Analysis	Apr 23, 2025	B471948
E2513197	Certificate of Analysis	Apr 23, 2025	B471948
E2513205	Certificate of Analysis	Apr 23, 2025	B471948
E2513213	Certificate of Analysis	Apr 23, 2025	B471948

Chemical and Physical Properties

Sensitivity	Hygroscopic
Melt Point(°C)	157-159°C
Molecular Weight	240.400 g/mol
XLogP3	5.800
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	0
Rotatable Bond Count	0
Exact Mass	240.169 Da
Monoisotopic Mass	240.169 Da
Topological Polar Surface Area	0.000 Å²
Heavy Atom Count	18
Formal Charge	0
Complexity	294.000
Isotope Atom Count	12
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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