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4-Methylbenz[a]anthracene-d3

CAT: 1459-CS-T-80025Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-T-80025Size:1 Each
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Description
4-Methylbenz[a]anthracene-d3 is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Anthracene. The product is supplied by Clearsynth under CAT No. CS-T-80025. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
1794971-11-1
Synonyms
4-Methylbenz[a]anthracene-d3
Molecular Formula
C 19 H 11 D 3
Molecular Weight
245.34
Additionnal Information
4-Methylbenz[a]anthracene-d3 is supplied with detailed characterization data compliant with regulatory guideline. 4-Methylbenz[a]anthracene-d3 can be used for analytical method development, method validation (AMV), Quality Control (QC) application for Abbreviated New Drug Application (ANDA), or during commercial production of Anthracene.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for complete information.

Chemical Information

4-Methylbenz[a]anthracene-d3
CAS Number1794971-11-1
PubChem CID71750208
IUPAC Name4-(trideuteriomethyl)benzo[a]anthracene
Molecular FormulaC19H14
Molecular Weight245.3
XLogP6.3
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count19
Formal Charge0
Complexity320
SMILES
[2H]C([2H])([2H])C1=C2C=CC3=CC4=CC=CC=C4C=C3C2=CC=C1
InChI
InChI=1S/C19H14/c1-13-5-4-8-18-17(13)10-9-16-11-14-6-2-3-7-15(14)12-19(16)18/h2-12H,1H3/i1D3
InChIKey
VXYNNEYZRYFXBG-FIBGUPNXSA-N
Chemical Structure
2D Structure
2D structure of 4-Methylbenz[a]anthracene-d3
CAS: 1794971-11-1
CID: 71750208
Formula: C19H14
MW: 245.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight245.3
XLogP36.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass245.128380684
Monoisotopic Mass245.128380684
Topological Polar Surface Area0 Ų
Heavy Atom Count19
Formal Charge0
Complexity320
Isotope Atom Count3
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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