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Cyclohexaneacetic acid, alpha,alpha-dimethyl- structure
Fine Chemical

Cyclohexaneacetic acid, alpha,alpha-dimethyl-

TL;DR: Cyclohexaneacetic acid, alpha,alpha-dimethyl- (CAS 16386-97-3) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-cyclohexyl-2-methylpropanoic acid

Also Known As: 2-cyclohexyl-2-methylpropanoic acid, 2-cyclohexyl-2-methylpropanoicacid, Cyclohexaneacetic acid, alpha,alpha-dimethyl-, 2-cyclohexyl-2-methyl-propanoic Acid, F8889-4798

CAS Number
16386-97-3
Molecular Formula
C10H18O2
Molecular Weight
170.13068 g/mol
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Application Areas

Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (4 patents) Catalysts (2 patents) Heterocyclic Building Blocks (27 patents) Organic Building Blocks (25 patents) Organometallic Reagents (2 patents)

Technical Specifications

Molecular FormulaC10H18O2
Molecular Weight170.13068 g/mol
XLogP3.4
Topological Polar Surface Area (TPSA)37.3 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors2
Rotatable Bonds2
Exact Mass170.13068 Da
Heavy Atoms12
Complexity167.0
SMILESCC(C)(C1CCCCC1)C(=O)O
InChIKeyLQTWWEVXGRFIDW-UHFFFAOYSA-N

Chemical Property Profile of Cyclohexaneacetic acid, alpha,alpha-dimethyl-

XLogP
3.4
TPSA (Topological Polar Surface Area)
37.3
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
2
Rotatable Bonds
2
Heavy Atoms
12
Complexity
167.0
Exact Mass
170.13068
Monoisotopic Mass
170.13068
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 Cyclohexaneacetic acid, alpha,alpha-dimethyl-

The XLogP value of 3.4 indicates that Cyclohexaneacetic acid, alpha,alpha-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Cyclohexaneacetic acid, alpha,alpha-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexaneacetic acid, alpha,alpha-dimethyl- 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 Cyclohexaneacetic acid, alpha,alpha-dimethyl-?

The CAS number of Cyclohexaneacetic acid, alpha,alpha-dimethyl- is 16386-97-3.

What is the molecular formula of Cyclohexaneacetic acid, alpha,alpha-dimethyl-?

The molecular formula of Cyclohexaneacetic acid, alpha,alpha-dimethyl- is C10H18O2.

What is the molecular weight of Cyclohexaneacetic acid, alpha,alpha-dimethyl-?

The molecular weight of Cyclohexaneacetic acid, alpha,alpha-dimethyl- is 170.13068 g/mol.

Where can I buy Cyclohexaneacetic acid, alpha,alpha-dimethyl-?

You can request a quote for Cyclohexaneacetic acid, alpha,alpha-dimethyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Cyclohexaneacetic acid, alpha,alpha-dimethyl-?

Yes, CoreyChem provides custom synthesis services for Cyclohexaneacetic acid, alpha,alpha-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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