Pseudooxynicotine-d4hydrochloride - ≥99% , CAS No.764661-23-6

CAS: 764661-23-6 Cat. No.: P649146 Formula: C10H12D4Cl2N2O Peso molecolare: 255.18
Disponibile su ordine
GRADE & PURITY ≥99%
Synonyms
DTXSID90478552 | 4-(methylamino)-1-(2,4,5,6-tetradeuteriopyridin-3-yl)butan-1-one | 4-(Methylamino)-1-(3-pyridyl-d4)-1-butanone Dihydrochloride | AKOS030242950
Storage
Store at 2-8°C,Desiccated
Shipped In
Wet ice
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Size
Germania (EU)
USA*
Price
Qty
1mg
P649146-1mg
Su ordinazione · 8–12 settimane
87,55€
5mg
P649146-5mg
Su ordinazione · 8–12 settimane
295,81€
10mg
P649146-10mg
Su ordinazione · 8–12 settimane
469,36€
25mg
P649146-25mg
Su ordinazione · 8–12 settimane
984,80€
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C,Desiccated Ships Wet ice Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Panoramica

Pseudooxynicotine-d 4 (hydrochloride) is the deuterium labeled Pseudooxynicotine hydrochloride.

In Vitro

Stable heavy isotopes of hydrogen, carbon, and other elements have been incorporated into drug molecules, largely as tracers for quantitation during the drug development process. Deuteration has gained attention because of its potential to affect the pharmacokinetic and metabolic profiles of drugs. MCE has not independently confirmed the accuracy of these methods. They are for reference only.

Form:Solid

Specifications

Sinonimi
DTXSID90478552 | 4-(methylamino)-1-(2,4,5,6-tetradeuteriopyridin-3-yl)butan-1-one | 4-(Methylamino)-1-(3-pyridyl-d4)-1-butanone Dihydrochloride | AKOS030242950
Specifiche e purezza
≥99%
Meccanismi biochimici e fisiologici
Pseudooxynicotine-d 4 (hydrochloride) is the deuterium labeled Pseudooxynicotine hydrochloride.
Condizioni di conservazione di stoccaggio
Store at 2-8°C,Desiccated
Spedito in
Wet ice
Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.
Purezza
≥99%
Nomi e identificatori
Sorrisi canonici
CNCCCC(=O)C1=CN=CC=C1
IUPAC Name
4-(methylamino)-1-(2,4,5,6-tetradeuteriopyridin-3-yl)butan-1-one
InChIKey
SGDIDUFQYHRMPR-TZMKMNDCSA-N
INCHI
1S/C10H14N2O/c1-11-6-3-5-10(13)9-4-2-7-12-8-9/h2,4,7-8,11H,3,5-6H2,1H3/i2D,4D,7D,8D
Isomeri SMILES
[2H]C1=C(C(=C(N=C1[2H])[2H])C(=O)CCCNC)[2H]
Peso molecolare
255.18
Reaxy-Rn
132948
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=132948&ln=

Documentazione

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganic oxygen compounds
ClasseOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones - Aryl ketones
Direct ParentAryl alkyl ketones
Alternative Parents Pyridines and derivatives  Gamma-amino ketones  Heteroaromatic compounds  Dialkylamines  Azacyclic compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Aryl alkyl ketone - Pyridine - Gamma-aminoketone - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Amine - Aromatic heteromonocyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group.
External Descriptors Not available
Struttura 3D
Modello di struttura chimica interattiva





Certificati (CoA, COO, BSE/TSE e tabella di analisi)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Proprietà chimiche e fisiche
Peso molecolare182.260 g/mol
XLogP30.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass182.136 Da
Monoisotopic Mass182.136 Da
Topological Polar Surface Area42.000 Ų
Heavy Atom Count13
Formal Charge0
Complexity159.000
Isotope Atom Count4
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calcolatori di soluzioni
Recensioni

Recensioni dei clienti

Domande frequenti

What is the purity of this product?
This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.
How should this product be stored?
Store at 2–8 °C, desiccated. Keep the container tightly closed with desiccant — the material is moisture-sensitive.
How is this product shipped?
This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.
What are the CAS number, molecular formula and molecular weight?
The CAS Number is 764661-23-6, the molecular formula is C10H12D4Cl2N2O, and the molecular weight is 255.18 g/mol. InChIKey SGDIDUFQYHRMPR-TZMKMNDCSA-N.
What documentation is provided?
Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.

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