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Pyrrole-2,3,4,5-d4

CAT: 1459-CS-C-00830Size: 1 EachDry Ice: NoHazardous: No
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CAT#:1459-CS-C-00830Size:1 Each
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Description
Pyrrole-2,3,4,5-d4 is listed under Stable Isotope Reagent and is intended for analytical research, quality control and pharmaceutical reference standard applications. It is associated with Pyrrole. The product is supplied by Clearsynth under CAT No. CS-C-00830. 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
17767-94-1
Synonyms
Pyrrole-2,3,4,5-d4
Molecular Formula
C 4 HD 4 N
Molecular Weight
71.12
Additionnal Information
Pyrrole-2,3,4,5-d4 is supplied with detailed characterization data compliant with regulatory guideline. Pyrrole-2,3,4,5-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 Pyrrole.
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

Pyrrole-2,3,4,5-d4
CAS Number17767-94-1
PubChem CID56845941
IUPAC Name2,3,4,5-tetradeuterio-1H-pyrrole
Molecular FormulaC4H5N
Molecular Weight71.11
XLogP0.7
Topological Polar Surface Area15.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Heavy Atom Count5
Formal Charge0
Complexity22
SMILES
[2H]C1=C(NC(=C1[2H])[2H])[2H]
InChI
InChI=1S/C4H5N/c1-2-4-5-3-1/h1-5H/i1D,2D,3D,4D
InChIKey
KAESVJOAVNADME-RHQRLBAQSA-N
Chemical Structure
2D Structure
2D structure of Pyrrole-2,3,4,5-d4
CAS: 17767-94-1
CID: 56845941
Formula: C4H5N
MW: 71.11
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight71.11
XLogP30.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count0
Rotatable Bond Count0
Exact Mass71.067306148
Monoisotopic Mass71.067306148
Topological Polar Surface Area15.8 Ų
Heavy Atom Count5
Formal Charge0
Complexity22.8
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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