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2-Hexylidenecyclopentan-1-one structure
Fine Chemical

2-Hexylidenecyclopentan-1-one

TL;DR: 2-Hexylidenecyclopentan-1-one (CAS 103517-09-5) is a chemical compound with molecular formula C11H18O and molecular weight 166.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-hexylidenecyclopentan-1-one

Also Known As: jasmalone, 2-hexylidenecyclopentan-1-one, 2-Hexylidenecyclopentanone, Cyclopentanone, 2-hexylidene-, 2-hexylidene cyclopentanone

CAS Number
103517-09-5
Molecular Formula
C11H18O
Molecular Weight
166.13577 g/mol
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Technical Specifications

Molecular FormulaC11H18O
Molecular Weight166.13577 g/mol
XLogP3.3
Topological Polar Surface Area (TPSA)17.1 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors1
Rotatable Bonds4
Exact Mass166.13577 Da
Heavy Atoms12
Complexity179.0
SMILESCCCCCC=C1CCCC1=O
InChIKeyWZPGQHVPSKTELT-UHFFFAOYSA-N

Chemical Property Profile of 2-Hexylidenecyclopentan-1-one

XLogP
3.3
TPSA (Topological Polar Surface Area)
17.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
1
Rotatable Bonds
4
Heavy Atoms
12
Complexity
179.0
Exact Mass
166.13577
Monoisotopic Mass
166.13577
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 2-Hexylidenecyclopentan-1-one

The XLogP value of 3.3 indicates that 2-Hexylidenecyclopentan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Hexylidenecyclopentan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hexylidenecyclopentan-1-one 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 2-Hexylidenecyclopentan-1-one?

The CAS number of 2-Hexylidenecyclopentan-1-one is 103517-09-5.

What is the molecular formula of 2-Hexylidenecyclopentan-1-one?

The molecular formula of 2-Hexylidenecyclopentan-1-one is C11H18O.

What is the molecular weight of 2-Hexylidenecyclopentan-1-one?

The molecular weight of 2-Hexylidenecyclopentan-1-one is 166.13577 g/mol.

Where can I buy 2-Hexylidenecyclopentan-1-one?

You can request a quote for 2-Hexylidenecyclopentan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-Hexylidenecyclopentan-1-one?

Yes, CoreyChem provides custom synthesis services for 2-Hexylidenecyclopentan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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