5-(Piperidin-4-yl)-1,3,4-oxadiazol-2(3H)-one hydrochloride - ≥97% , CAS No.1046079-35-9

CAS: 1046079-35-9 Cat. No.: P189481 Peso molecular: 205.64 Número EC: 821-300-5 PubChem CID: 24950191
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
5-(Piperidin-4-yl)-1,3,4-oxadiazol-2(3H)-one--hydrogen chloride (1/1) | 1046079-35-9 | 5-(Piperidin-4-yl)-1,3,4-oxadiazol-2(3H)-one hydrochloride | DTXSID50648057 | 5-(piperidin-4-yl)-2,3-dihydro-1,3,4-oxadiazol-2-one hydrochloride | SCHEMBL19283902 | XIY
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
250mg
P189481-250mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

60,90US$

91,90US$
Guardar 31,00 US$ (33.73%)
1g
P189481-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

161,90US$

242,90US$
Guardar 81,00 US$ (33.35%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal 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.

Specifications

Sinónimos
5-(Piperidin-4-yl)-1, 3, 4-oxadiazol-2(3H)-one--hydrogen chloride (1/1) | 1046079-35-9 | 5-(Piperidin-4-yl)-1, 3, 4-oxadiazol-2(3H)-one hydrochloride | DTXSID50648057 | 5-(piperidin-4-yl)-2, 3-dihydro-1, 3, 4-oxadiazol-2-one hydrochloride | SCHEMBL19283902 | XIY
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥97%
Nombres e identificadores
Sonrisas canónicasC1CNCCC1C2=NNC(=O)O2.Cl
IUPAC Name5-piperidin-4-yl-3H-1,3,4-oxadiazol-2-one;hydrochloride
InChIKeyXIYYNNHQVKXBLL-UHFFFAOYSA-N
INCHI1S/C7H11N3O2.ClH/c11-7-10-9-6(12-7)5-1-3-8-4-2-5;/h5,8H,1-4H2,(H,10,11);1H
Isómeros SMILES C1CNCCC1C2=NNC(=O)O2.Cl
PubChem CID 24950191
Peso molecular 205.64

Documentation

📋 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 nitrogen compounds
ClaseOrganonitrogen compounds
SubclassAmines
Intermediate Tree Nodes Not available
Direct ParentAralkylamines
Alternative Parents Piperidines  Heteroaromatic compounds  1,3,4-oxadiazoles  Oxacyclic compounds  Dialkylamines  Azacyclic compounds  Organooxygen compounds  Organic oxides  Hydrochlorides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Aralkylamine - Piperidine - 1,3,4-oxadiazole - Azole - Oxadiazole - Heteroaromatic compound - Secondary aliphatic amine - Oxacycle - Secondary amine - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Hydrochloride - Aromatic heteromonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl group.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
GABRA4 Tclin GABA receptor alpha-4 subunit (15 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GABRA6 Tclin GABA receptor alpha-6 subunit (26 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GABRA3 Tclin GABA receptor alpha-3 subunit (187 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
GABRB2 Tclin GABA A receptor alpha-2/beta-2/gamma-2 (194 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Gabrg2 GABA-A receptor; alpha-1/beta-2/gamma-2 (554 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propiedades químicas y físicas
Peso molecular205.640 g/mol
XLogP3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass205.062 Da
Monoisotopic Mass205.062 Da
Topological Polar Surface Area62.700 Ų
Heavy Atom Count13
Formal Charge0
Complexity221.000
Isotope Atom Count0
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 Count2
Calculadoras de soluciones
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