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3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid structure
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3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid

TL;DR: 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid (CAS 34675-84-8) is a chemical compound with molecular formula C17H23NO4 and molecular weight 305.16272 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[4-[4-(aminomethyl)cyclohexanecarbonyl]oxyphenyl]propanoic acid

Also Known As: Cetraxate, Cetraxato, Neuer, Cetraxatum, Cetraxate [INN]

CAS Number
34675-84-8
Molecular Formula
C17H23NO4
Molecular Weight
305.16272 g/mol
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Application Areas

Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (4 patents) Analytical Reagents (1 patents) Biotechnology (21 patents) Coatings & Adhesives (6 patents) Food Additives (1 patents)

Technical Specifications

Molecular FormulaC17H23NO4
Molecular Weight305.16272 g/mol
XLogP-0.4
Topological Polar Surface Area (TPSA)89.6 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors5
Rotatable Bonds7
Exact Mass305.16272 Da
Heavy Atoms22
Complexity369.0
SMILESC1CC(CCC1CN)C(=O)OC2=CC=C(C=C2)CCC(=O)O
InChIKeyFHRSHSOEWXUORL-UHFFFAOYSA-N

Product Description

Applications: 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid (CAS 34675-84-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid (CAS 34675-84-8) is a pharmaceutical intermediate with the molecular formula C17H23NO4 and a molecular weight of 305.16 g/mol. It is also known as Cetraxate and Cetraxato.

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 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid

XLogP
-0.4
TPSA (Topological Polar Surface Area)
89.6
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
5
Rotatable Bonds
7
Heavy Atoms
22
Complexity
369.0
Exact Mass
305.16272
Monoisotopic Mass
305.16272
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 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid

The XLogP value of -0.4 indicates that 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid. Following Lipinski's Rule of Five, 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid?

The CAS number of 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid is 34675-84-8.

What is the molecular formula of 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid?

The molecular formula of 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid is C17H23NO4.

What is the molecular weight of 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid?

The molecular weight of 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid is 305.16272 g/mol.

What are the applications of 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid?

3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis....

Where can I buy 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid?

You can request a quote for 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid?

Yes, CoreyChem provides custom synthesis services for 3-(4-((4-(Aminomethyl)cyclohexane-1-carbonyl)oxy)phenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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