Kelletinin I

[(2S,3R)-2,3,4-tris[(4-hydroxybenzoyl)oxy]butyl] 4-hydroxybenzoate

CAS: 87697-99-2

Molecular Formula	`C32H26O12`
Molecular Weight	602.5 g/mol
LogP	5.1
Topological Polar Surface Area	186.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	12
Rotatable Bonds	15
Exact Mass	602.14246
Heavy Atoms	44
Complexity	863.0

Chemical Identifiers

CAS Number	87697-99-2
SMILES	`C1=CC(=CC=C1C(=O)OCC(C(COC(=O)C2=CC=C(C=C2)O)OC(=O)C3=CC=C(C=C3)O)OC(=O)C4=CC=C(C=C4)O)O`
InChIKey	`UFYXGHSICNSXJL-HNRBIFIRSA-N`

📖 Product Overview

Kelletinin I (CAS: 87697-99-2) is a chemical compound with molecular formula C32H26O12 and molecular weight 602.5 g/mol. Its IUPAC systematic name is [(2S,3R)-2,3,4-tris[(4-hydroxybenzoyl)oxy]butyl] 4-hydroxybenzoate. LogP 5.1 Topological Polar Surface Area 186.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 12 Rotatable Bonds 15 Exact Mass 602.14246 Heavy Atoms 44 Complexity 863.0 InChI Key: UFYXGHSICNSXJL-HNRBIFIRSA-N. SMILES: C1=CC(=CC=C1C(=O)OCC(C(COC(=O)C2=CC=C(C=C2)O)OC(=O)C3=CC=C(C=C3)O)OC(=O)C4=CC=C(C=C4)O)O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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Frequently Asked Questions

What is the typical lead time for this product?

Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.

Can you provide samples for testing?

Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.

What documentation do you provide with the product?

We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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