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5-Hydroxyindoleacetic Acid structure
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5-Hydroxyindoleacetic Acid

TL;DR: 5-Hydroxyindoleacetic Acid (CAS 54-16-0) is a chemical compound with molecular formula C10H9NO3 and molecular weight 191.05824 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-(5-hydroxy-1H-indol-3-yl)acetic acid

Also Known As: 5-Hydroxyindole-3-acetic acid, 5-HIAA, 2-(5-hydroxy-1H-indol-3-yl)acetic acid, 5-Hydroxyindoleacetic acid, Hydroxyindoleacetic acid

CAS Number
54-16-0
Molecular Formula
C10H9NO3
Molecular Weight
191.05824 g/mol
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Application Areas

Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (17 patents) Analytical Reagents (178 patents) Biotechnology (257 patents) Catalysts (1 patents) Dyes & Pigments (1 patents)

Technical Specifications

Molecular FormulaC10H9NO3
Molecular Weight191.05824 g/mol
XLogP1.1
Topological Polar Surface Area (TPSA)73.3 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors3
Rotatable Bonds2
Exact Mass191.05824 Da
Heavy Atoms14
Complexity231.0
Melting Point161 - 163 °C
Solubility24 mg/mL
SMILESC1=CC2=C(C=C1O)C(=CN2)CC(=O)O
InChIKeyDUUGKQCEGZLZNO-UHFFFAOYSA-N

Product Description

Applications: 5-Hydroxyindoleacetic 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. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).

5-Hydroxyindoleacetic Acid (CAS 54-16-0) is a pharmaceutical intermediate with the molecular formula C10H9NO3 and a molecular weight of 191.06 g/mol. Key physical properties include a solubility: 24 mg/mL. Synonyms include 5-Hydroxyindole-3-acetic acid and 5-HIAA.

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 5-Hydroxyindoleacetic Acid

XLogP
1.1
TPSA (Topological Polar Surface Area)
73.3
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
3
Rotatable Bonds
2
Heavy Atoms
14
Complexity
231.0
Exact Mass
191.05824
Monoisotopic Mass
191.05824
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 5-Hydroxyindoleacetic Acid

The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Hydroxyindoleacetic Acid. The TPSA of 73.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Hydroxyindoleacetic Acid. Following Lipinski's Rule of Five, 5-Hydroxyindoleacetic Acid has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 5-Hydroxyindoleacetic Acid?

The CAS number of 5-Hydroxyindoleacetic Acid is 54-16-0.

What is the molecular formula of 5-Hydroxyindoleacetic Acid?

The molecular formula of 5-Hydroxyindoleacetic Acid is C10H9NO3.

What is the molecular weight of 5-Hydroxyindoleacetic Acid?

The molecular weight of 5-Hydroxyindoleacetic Acid is 191.05824 g/mol.

What are the applications of 5-Hydroxyindoleacetic Acid?

5-Hydroxyindoleacetic 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. Available from CoreyChem as both catalog item...

Where can I buy 5-Hydroxyindoleacetic Acid?

You can request a quote for 5-Hydroxyindoleacetic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5-Hydroxyindoleacetic Acid?

Yes, CoreyChem provides custom synthesis services for 5-Hydroxyindoleacetic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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