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Citronellal structure
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Citronellal

TL;DR: Citronellal (CAS 106-23-0) is a chemical compound with molecular formula C10H18O and molecular weight 154.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3,7-dimethyloct-6-enal

Also Known As: CITRONELLAL, 3,7-Dimethyloct-6-enal, Rhodinal, 3,7-Dimethyl-6-octenal, Citronellel

CAS Number
106-23-0
Molecular Formula
C10H18O
Molecular Weight
154.13577 g/mol
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Application Areas

Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (921 patents) Analytical Reagents (51 patents) Biotechnology (198 patents) Catalysts (224 patents) Coatings & Adhesives (62 patents)

Technical Specifications

Molecular FormulaC10H18O
Molecular Weight154.13577 g/mol
XLogP3.0
Topological Polar Surface Area (TPSA)17.1 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors1
Rotatable Bonds5
Exact Mass154.13577 Da
Heavy Atoms11
Complexity132.0
Melting Point147 °C
Boiling Point205 °C
Density0.853 g/cu cm at 20 °C
Flash Point165 °F (74 °C) (CLOSED CUP)
Vapor Pressure0.28 [mmHg]
Refractive IndexIndex of refraction: 1.446 at 20 °C/D
SolubilitySlightly soluble in water
SMILESCC(CCC=C(C)C)CC=O
InChIKeyNEHNMFOYXAPHSD-UHFFFAOYSA-N

Product Description

Applications: Citronellal is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Citronellal (CAS 106-23-0) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Citronellal (CAS 106-23-0) is a pharmaceutical intermediate with the molecular formula C10H18O and a molecular weight of 154.14 g/mol. Key physical properties include a density of 0.853 g/cu cm at 20 °C g/cm³, a solubility: Slightly soluble in water. It is also known as CITRONELLAL and 3,7-Dimethyloct-6-enal.

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 Citronellal

XLogP
3.0
TPSA (Topological Polar Surface Area)
17.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
5
Heavy Atoms
11
Complexity
132.0
Exact Mass
154.13577
Monoisotopic Mass
154.13577
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 Citronellal

The XLogP value of 3.0 indicates that Citronellal is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, Citronellal exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Citronellal has 0 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 Citronellal?

The CAS number of Citronellal is 106-23-0.

What is the molecular formula of Citronellal?

The molecular formula of Citronellal is C10H18O.

What is the molecular weight of Citronellal?

The molecular weight of Citronellal is 154.13577 g/mol.

What are the applications of Citronellal?

Citronellal is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Citronellal (CAS 106-23-0) with custom synthesis available from milligram to...

Where can I buy Citronellal?

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

Does CoreyChem offer custom synthesis for Citronellal?

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

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