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2-(Propan-2-yl)nonanoic acid structure
Fine Chemical

2-(Propan-2-yl)nonanoic acid

TL;DR: 2-(Propan-2-yl)nonanoic acid (CAS 116988-32-0) is a chemical compound with molecular formula C12H24O2 and molecular weight 200.17763 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-propan-2-ylnonanoic acid

Also Known As: 2-isopropyl-nonanoic acid, 2-(propan-2-yl)nonanoic acid, 2-propan-2-ylnonanoic acid, 2-(1-Methylethyl)nonanoic acid

CAS Number
116988-32-0
Molecular Formula
C12H24O2
Molecular Weight
200.17763 g/mol
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Application Areas

Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.

Heterocyclic Building Blocks (3 patents) Pharmaceutical Intermediates (1 patents)

Technical Specifications

Molecular FormulaC12H24O2
Molecular Weight200.17763 g/mol
XLogP4.7
Topological Polar Surface Area (TPSA)37.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds8
Exact Mass200.17763 Da
Heavy Atoms14
Complexity152.0
SMILESCCCCCCCC(C(C)C)C(=O)O
InChIKeyVKCQHIOLPAHDPV-UHFFFAOYSA-N

Chemical Property Profile of 2-(Propan-2-yl)nonanoic acid

XLogP
4.7
TPSA (Topological Polar Surface Area)
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
8
Heavy Atoms
14
Complexity
152.0
Exact Mass
200.17763
Monoisotopic Mass
200.17763
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-(Propan-2-yl)nonanoic acid

The XLogP value of 4.7 indicates that 2-(Propan-2-yl)nonanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(Propan-2-yl)nonanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Propan-2-yl)nonanoic acid has 1 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 2-(Propan-2-yl)nonanoic acid?

The CAS number of 2-(Propan-2-yl)nonanoic acid is 116988-32-0.

What is the molecular formula of 2-(Propan-2-yl)nonanoic acid?

The molecular formula of 2-(Propan-2-yl)nonanoic acid is C12H24O2.

What is the molecular weight of 2-(Propan-2-yl)nonanoic acid?

The molecular weight of 2-(Propan-2-yl)nonanoic acid is 200.17763 g/mol.

Where can I buy 2-(Propan-2-yl)nonanoic acid?

You can request a quote for 2-(Propan-2-yl)nonanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-(Propan-2-yl)nonanoic acid?

Yes, CoreyChem provides custom synthesis services for 2-(Propan-2-yl)nonanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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