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Indole-3-Butyric Acid structure
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Indole-3-Butyric Acid

TL;DR: Indole-3-Butyric Acid (CAS 133-32-4) is a chemical compound with molecular formula C12H13NO2 and molecular weight 203.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-(1H-indol-3-yl)butanoic acid

Also Known As: Indole-3-butyric acid, 3-Indolebutyric acid, Indolebutyric acid, Hormodin, 4-(1H-Indol-3-yl)butanoic acid

CAS Number
133-32-4
Molecular Formula
C12H13NO2
Molecular Weight
203.09464 g/mol
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Application Areas

Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (1016 patents) Analytical Reagents (68 patents) Biotechnology (1454 patents) Catalysts (1 patents) Coatings & Adhesives (5 patents)

Technical Specifications

Molecular FormulaC12H13NO2
Molecular Weight203.09464 g/mol
XLogP2.3
Topological Polar Surface Area (TPSA)53.1 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors2
Rotatable Bonds4
Exact Mass203.09464 Da
Heavy Atoms15
Complexity230.0
Melting Point124.5
Vapor Pressure0.00000117 [mmHg]
Solubility250
SMILESC1=CC=C2C(=C1)C(=CN2)CCCC(=O)O
InChIKeyJTEDVYBZBROSJT-UHFFFAOYSA-N

Product Description

Applications: Indole-3-Butyric Acid is used in biotechnology workflows and life-science research, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Indole-3-Butyric Acid (CAS 133-32-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.

Indole-3-Butyric Acid is a biotechnology compound identified by CAS number 133-32-4 and the molecular formula C12H13NO2 and a molecular weight of 203.09 g/mol. Physically, the compound has a solubility: 250. It is also known as Indole-3-butyric acid and 3-Indolebutyric acid.

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 Indole-3-Butyric Acid

XLogP
2.3
TPSA (Topological Polar Surface Area)
53.1
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
2
Rotatable Bonds
4
Heavy Atoms
15
Complexity
230.0
Exact Mass
203.09464
Monoisotopic Mass
203.09464
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 Indole-3-Butyric Acid

The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indole-3-Butyric Acid. With a topological polar surface area (TPSA) of 53.1 Ų, Indole-3-Butyric Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole-3-Butyric Acid has 2 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 Indole-3-Butyric Acid?

The CAS number of Indole-3-Butyric Acid is 133-32-4.

What is the molecular formula of Indole-3-Butyric Acid?

The molecular formula of Indole-3-Butyric Acid is C12H13NO2.

What is the molecular weight of Indole-3-Butyric Acid?

The molecular weight of Indole-3-Butyric Acid is 203.09464 g/mol.

What are the applications of Indole-3-Butyric Acid?

Indole-3-Butyric Acid is used in biotechnology workflows and life-science research, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Indole-3-Butyric Acid (CAS...

Where can I buy Indole-3-Butyric Acid?

You can request a quote for Indole-3-Butyric Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Indole-3-Butyric Acid?

Yes, CoreyChem provides custom synthesis services for Indole-3-Butyric Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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