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1,4-Phenylenediamine-d4

CAT: 1459-CS-T-60413Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-T-60413Size:1 Each
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Description
1,4-Phenylenediamine-d4 is listed under Stable Isotopes and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Amine. The product is supplied by Clearsynth under CAT No. CS-T-60413. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
For Deuterated product research and analysis purpose. Used in polymer research and as a labeled intermediate in dye synthesis
CAS Number
119516-83-5
Synonyms
1,4-Phenylenediamine-d4
Molecular Formula
C 6 H 4 D 4 N 2
Molecular Weight
112.17
Additionnal Information
1,4-Phenylenediamine-d4 is supplied with detailed characterization data compliant with regulatory guideline. 1,4-Phenylenediamine-d4 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 Amine.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
For Deuterated product research and analysis purpose. Used in polymer research and as a labeled intermediate in dye synthesis
HSN Code
38229010
Hazard Compound
Refer MSDS for accurate information.

Chemical Information

1,4-Phenylenediamine-2,3,5,6-d4
CAS Number119516-83-5
PubChem CID16213352
IUPAC Name2,3,5,6-tetradeuteriobenzene-1,4-diamine
Molecular FormulaC6H8N2
Molecular Weight112.17
XLogP-0.3
Topological Polar Surface Area52
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Heavy Atom Count8
Formal Charge0
Complexity54
SMILES
[2H]C1=C(C(=C(C(=C1N)[2H])[2H])N)[2H]
InChI
InChI=1S/C6H8N2/c7-5-1-2-6(8)4-3-5/h1-4H,7-8H2/i1D,2D,3D,4D
InChIKey
CBCKQZAAMUWICA-RHQRLBAQSA-N
Chemical Structure
2D Structure
2D structure of 1,4-Phenylenediamine-2,3,5,6-d4
CAS: 119516-83-5
CID: 16213352
Formula: C6H8N2
MW: 112.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight112.17
XLogP3-0.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass112.093855247
Monoisotopic Mass112.093855247
Topological Polar Surface Area52 Ų
Heavy Atom Count8
Formal Charge0
Complexity54.9
Isotope Atom Count4
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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