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Diphenidol structure
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Diphenidol

TL;DR: Diphenidol (CAS 972-02-1) is a chemical compound with molecular formula C21H27NO and molecular weight 309.20926 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

1,1-diphenyl-4-piperidin-1-ylbutan-1-ol

Also Known As: Difenidol, Vontrol, Nometic, Avomol, Cephadol

CAS Number
972-02-1
Molecular Formula
C21H27NO
Molecular Weight
309.20926 g/mol
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Application Areas

Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (25 patents) Analytical Reagents (26 patents) Biotechnology (14 patents) Catalysts (7 patents) Coatings & Adhesives (6 patents)

Technical Specifications

Molecular FormulaC21H27NO
Molecular Weight309.20926 g/mol
XLogP4.2
Topological Polar Surface Area (TPSA)23.5 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds6
Exact Mass309.20926 Da
Heavy Atoms23
Complexity307.0
Melting Point212-214
SolubilityCRYSTALS FROM CHLOROFORM + ETHYL ACETATE; FREELY SOL IN METHANOL; SOL IN WATER & CHLOROFORM; PRACTICALLY INSOL IN ETHER, BENZENE, & PETROLEUM ETHER /HCL/
SMILESC1CCN(CC1)CCCC(C2=CC=CC=C2)(C3=CC=CC=C3)O
InChIKeyOGAKLTJNUQRZJU-UHFFFAOYSA-N

Product Description

Applications: Diphenidol is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

Diphenidol (CAS 972-02-1) is a pharmaceutical intermediate with the molecular formula C21H27NO and a molecular weight of 309.21 g/mol. Key physical properties include a solubility: CRYSTALS FROM CHLOROFORM + ETHYL ACETATE; FREELY SOL IN METHANOL; SOL IN WATER & CHLOROFORM; PRACTICALLY INSOL IN ETHER, BENZENE, & PETROLEUM ETHER /HCL/. Synonyms include Difenidol and Vontrol.

Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.

Chemical Property Profile of Diphenidol

XLogP
4.2
TPSA (Topological Polar Surface Area)
23.5
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
6
Heavy Atoms
23
Complexity
307.0
Exact Mass
309.20926
Monoisotopic Mass
309.20926
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Diphenidol

The XLogP value of 4.2 indicates that Diphenidol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, Diphenidol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenidol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Diphenidol?

The CAS number of Diphenidol is 972-02-1.

What is the molecular formula of Diphenidol?

The molecular formula of Diphenidol is C21H27NO.

What is the molecular weight of Diphenidol?

The molecular weight of Diphenidol is 309.20926 g/mol.

What are the applications of Diphenidol?

Diphenidol is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...

Where can I buy Diphenidol?

You can request a quote for Diphenidol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Diphenidol?

Yes, CoreyChem provides custom synthesis services for Diphenidol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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