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Dehydronerolidol structure
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Dehydronerolidol

TL;DR: Dehydronerolidol (CAS 54325-12-1) is a chemical compound with molecular formula C15H24O and molecular weight 220.18271 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3,7,11-trimethyldodeca-6,10-dien-1-yn-3-ol

Also Known As: Dehydronerolidol, 3,7,11-Trimethyldodeca-6,10-dien-1-yn-3-ol, 6,10-Dodecadien-1-yn-3-ol, 3,7,11-trimethyl-, AI3-25087, EC 259-104-1

CAS Number
54325-12-1
Molecular Formula
C15H24O
Molecular Weight
220.18271 g/mol
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Application Areas

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

Coatings & Adhesives (1 patents) Heterocyclic Building Blocks (1 patents) Organic Building Blocks (28 patents) Organometallic Reagents (1 patents) Pharmaceutical Intermediates (5 patents)

Technical Specifications

Molecular FormulaC15H24O
Molecular Weight220.18271 g/mol
XLogP4.1
Topological Polar Surface Area (TPSA)20.2 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors1
Rotatable Bonds7
Exact Mass220.18271 Da
Heavy Atoms16
Complexity310.0
SMILESCC(=CCCC(=CCCC(C)(C#C)O)C)C
InChIKeyZNVPGYAGXVEAFP-UHFFFAOYSA-N

Chemical Property Profile of Dehydronerolidol

XLogP
4.1
TPSA (Topological Polar Surface Area)
20.2
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
1
Rotatable Bonds
7
Heavy Atoms
16
Complexity
310.0
Exact Mass
220.18271
Monoisotopic Mass
220.18271
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 Dehydronerolidol

The XLogP value of 4.1 indicates that Dehydronerolidol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Dehydronerolidol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dehydronerolidol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Dehydronerolidol?

The CAS number of Dehydronerolidol is 54325-12-1.

What is the molecular formula of Dehydronerolidol?

The molecular formula of Dehydronerolidol is C15H24O.

What is the molecular weight of Dehydronerolidol?

The molecular weight of Dehydronerolidol is 220.18271 g/mol.

Where can I buy Dehydronerolidol?

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

Does CoreyChem offer custom synthesis for Dehydronerolidol?

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

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