Dechlorohaloperidol , CAS No.3109-12-4

CAS: 3109-12-4 Cat. No.: D667859 Fórmula: C21H24FNO2 Peso molecular: 341.4 Número CE: 691-107-7 PubChem CID: 18367
Disponível para encomenda
Synonyms
Dechlorohaloperidol | Dechloro Haloperidol | 1-(4-fluorophenyl)-4-(4-hydroxy-4-phenylpiperidin-1-yl)butan-1-one | Dechloro Haloperidol (Haloperidol Impurity B) | BUTYROPHENONE, 4'-FLUORO-4-(4-HYDROXY-4-PHENYLPIPERIDINO)- | QKZ09O18R6 | BRN 0316568 | UNII-
Storage
Room temperature
★
Size
Alemanha (EU)
USA*
Price
Qty
1mg
D667859-1mg
Sob encomenda · 8–12 semanas

496,26€

744,43€
Gravar 248,17 € (33.34%)
5mg
D667859-5mg
Sob encomenda · 8–12 semanas

1735,39€

2603,13€
Gravar 867,74 € (33.33%)
Enter a quantity for the sizes you want to add.
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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships 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
Dechlorohaloperidol | Dechloro Haloperidol | 1-(4-fluorophenyl)-4-(4-hydroxy-4-phenylpiperidin-1-yl)butan-1-one | Dechloro Haloperidol (Haloperidol Impurity B) | BUTYROPHENONE, 4'-FLUORO-4-(4-HYDROXY-4-PHENYLPIPERIDINO)- | QKZ09O18R6 | BRN 0316568 | UNII-
Condições de armazenamento de armazenamento
Room temperature
Propriedades do produto
ALogP2.6
Nomes e identificadores
Sorrisos canónicosC1CN(CCC1(C2=CC=CC=C2)O)CCCC(=O)C3=CC=C(C=C3)F
IUPAC Name1-(4-fluorophenyl)-4-(4-hydroxy-4-phenylpiperidin-1-yl)butan-1-one
InChIKeyFEFFZKPQSVTBAY-UHFFFAOYSA-N
INCHI1S/C21H24FNO2/c22-19-10-8-17(9-11-19)20(24)7-4-14-23-15-12-21(25,13-16-23)18-5-2-1-3-6-18/h1-3,5-6,8-11,25H,4,7,12-16H2
SMILES isoméricas C1CN(CCC1(C2=CC=CC=C2)O)CCCC(=O)C3=CC=C(C=C3)F
PubChem CID 18367
Peso molecular 341.4

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 oxygen compounds
ClasseOrganooxygen compounds
SubclassCarbonyl compounds
Intermediate Tree Nodes Ketones - Aryl ketones - Phenylketones
Direct ParentAlkyl-phenylketones
Alternative Parents Phenylpiperidines  Butyrophenones  Phenylbutylamines  Aryl alkyl ketones  Benzoyl derivatives  Fluorobenzenes  Aralkylamines  Gamma-amino ketones  Aryl fluorides  Tertiary alcohols  Trialkylamines  Azacyclic compounds  Organofluorides  Organic oxides  Hydrocarbon derivatives  Organopnictogen compounds  
Molecular FrameworkAromatic heteromonocyclic compounds
Substituents Alkyl-phenylketone - Phenylpiperidine - Butyrophenone - Phenylbutylamine - Aryl alkyl ketone - Benzoyl - Aralkylamine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Piperidine - Gamma-aminoketone - Tertiary alcohol - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Organohalogen compound - Amine - Organic nitrogen compound - Organopnictogen compound - Alcohol - Organic oxide - Hydrocarbon derivative - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors Not available
Estrutura 3D
Modelo de Estrutura Química Interativa





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Mecanismos de ação
Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Propriedades químicas e físicas
Peso molecular341.400 g/mol
XLogP32.600
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass341.179 Da
Monoisotopic Mass341.179 Da
Topological Polar Surface Area40.500 Ų
Heavy Atom Count25
Formal Charge0
Complexity420.000
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 Count1
Calculadoras de soluções
Revisões

Avaliações dos Clientes

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