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Adamantane structure
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Adamantane

TL;DR: Adamantane (CAS 281-23-2) is a chemical compound with molecular formula C10H16 and molecular weight 136.1252 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

adamantane

Also Known As: Adamantan, Tricyclo[3.3.1.13,7]decane, diamantane (obsolete), Adamantane; >99%, tricyclo[3.3.1.1]decane

CAS Number
281-23-2
Molecular Formula
C10H16
Molecular Weight
136.1252 g/mol
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Application Areas

Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (220 patents) Analytical Reagents (484 patents) Biotechnology (1103 patents) Catalysts (270 patents) Coatings & Adhesives (194 patents)

Technical Specifications

Molecular FormulaC10H16
Molecular Weight136.1252 g/mol
XLogP3.8
Topological Polar Surface Area (TPSA)0.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors0
Rotatable Bonds0
Exact Mass136.1252 Da
Heavy Atoms10
Complexity75.0
SMILESC1C2CC3CC1CC(C2)C3
InChIKeyORILYTVJVMAKLC-UHFFFAOYSA-N

Product Description

Applications: Adamantane 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).

A pharmaceutical intermediate supplied by CoreyChem, Adamantane (CAS 281-23-2) has the molecular formula C10H16 and a molecular weight of 136.13 g/mol. Synonyms include Adamantan and Tricyclo[3.3.1.13,7]decane.

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 Adamantane

XLogP
3.8
TPSA (Topological Polar Surface Area)
0.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
Rotatable Bonds
0
Heavy Atoms
10
Complexity
75.0
Exact Mass
136.1252
Monoisotopic Mass
136.1252
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 Adamantane

The XLogP value of 3.8 indicates that Adamantane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, Adamantane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Adamantane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Adamantane?

The CAS number of Adamantane is 281-23-2.

What is the molecular formula of Adamantane?

The molecular formula of Adamantane is C10H16.

What is the molecular weight of Adamantane?

The molecular weight of Adamantane is 136.1252 g/mol.

What are the applications of Adamantane?

Adamantane 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 Adamantane?

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

Does CoreyChem offer custom synthesis for Adamantane?

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

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