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[(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate structure
Fine Chemical

[(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate

TL;DR: [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate (CAS 82040-94-6) is a chemical compound with molecular formula C17H28O2 and molecular weight 264.20892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate

Also Known As: Cedryl acetate, Cedrol acetate, Cedranyl acetate, Cedrol, acetate, (+)-Cedryl acetate

CAS Number
82040-94-6
Molecular Formula
C17H28O2
Molecular Weight
264.20892 g/mol
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Application Areas

Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.

Pharmaceutical Intermediates (4 patents)

Technical Specifications

Molecular FormulaC17H28O2
Molecular Weight264.20892 g/mol
XLogP4.5
Topological Polar Surface Area (TPSA)26.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass264.20892 Da
Heavy Atoms19
Complexity413.0
SMILESC[C@@H]1CC[C@@H]2C13CCC(C(C3)C2(C)C)(C)OC(=O)C
InChIKeyHQKQRXZEXPXXIG-GXTNNVKYSA-N

Product Description

Applications: [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate is used in pharmaceutical synthesis routes and API production. 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).

[(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate (CAS 82040-94-6) is a pharmaceutical intermediate with the molecular formula C17H28O2 and a molecular weight of 264.21 g/mol. Synonyms include Cedryl acetate and Cedrol acetate.

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 [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate

XLogP
4.5
TPSA (Topological Polar Surface Area)
26.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
19
Complexity
413.0
Exact Mass
264.20892
Monoisotopic Mass
264.20892
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 [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate

The XLogP value of 4.5 indicates that [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate has 0 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 [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate?

The CAS number of [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate is 82040-94-6.

What is the molecular formula of [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate?

The molecular formula of [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate is C17H28O2.

What is the molecular weight of [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate?

The molecular weight of [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate is 264.20892 g/mol.

What are the applications of [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate?

[(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate is used in pharmaceutical synthesis routes and API production. 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...

Where can I buy [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate?

You can request a quote for [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate?

Yes, CoreyChem provides custom synthesis services for [(2R,5S)-2,6,6,8-tetramethyl-8-tricyclo[5.3.1.01,5]undecanyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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