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Nicotinamide-d4 (Major)

CAT: 0572-TRC-N407753-10MGSize: 10 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-N407753-10MGSize:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
347841-88-7
Synonyms
3-Pyridinecarboxamide-d4; 3-(Aminocarbonyl)pyridine-d4; 3-Amidopyridine-d4; 3-Carbamoylpyridine-d4; 3-Pyridinecarboxylic acid amide-d4; Aminicotin-d4; Benicot-d4; Nicosylamide-d4; Nicotilamide-d4; Nicotinic Acid Amide-d4; Vitamin B-d4; Vitamin B3-d4; Nicotinamide-d4
Hazard Statement
Harmful if inhaled
Purity
>95% (HPLC)
Smiles
[2H]c1nc([2H])c(C(=O)N)c([2H])c1[2H]
Molecular Formula
C6 2H4 H2 N2 O
Molecular Weight
126.15
InChI
InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)/i1D,2D,3D,4D
Additionnal Information
IUPAC name: 2,4,5,6-tetradeuteriopyridine-3-carboxamide
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

(~2~H_4_)Pyridine-3-carboxamide
CAS Number347841-88-7
PubChem CID15554909
IUPAC Name2,4,5,6-tetradeuteriopyridine-3-carboxamide
Molecular FormulaC6H6N2O
Molecular Weight126.15
XLogP-0.4
Topological Polar Surface Area56
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count9
Formal Charge0
Complexity114
SMILES
[2H]C1=C(C(=C(N=C1[2H])[2H])C(=O)N)[2H]
InChI
InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)/i1D,2D,3D,4D
InChIKey
DFPAKSUCGFBDDF-RHQRLBAQSA-N
Chemical Structure
2D Structure
2D structure of (~2~H_4_)Pyridine-3-carboxamide
CAS: 347841-88-7
CID: 15554909
Formula: C6H6N2O
MW: 126.15
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight126.15
XLogP3-0.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass126.073119803
Monoisotopic Mass126.073119803
Topological Polar Surface Area56 Ų
Heavy Atom Count9
Formal Charge0
Complexity114
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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Alternative Products

CatalogName
018096Nicotinamide-d4 (Major)
469744-01β-Nicotinamide-d4 Mononucleotide (d4-major)
sc-478217β-Nicotinamide-d4 Mononucleotide (d3-major)
sc-478413β-Nicotinamide adenine dinucleotide-d4 (d3 major)
sc-478246Nicotinamide Riboside-d4 Triflate (d3-Major) α/β mixture
CS-T-94963Nicotinamide Riboside-d4 Triflate (d3-Major) a/b mixture
MBS6062436-01Nicotinamide Riboside-d4 Triflate (d3-Major) alpha/beta mixture
CS-O-10380Betamethasone-d4, d5 (d4 major)
CS-F-00244Upadacitinib-d4 (major)
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