Acacetin

• CAS: 480-44-4
• Catalog Number: ACM480444
• Category: Other Products
• Molecular Weight: 284.26
• Molecular Formula: C16H12O5
• Synonyms: 5,7-Dihydroxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
• IUPAC Name: 5,7-Dihydroxy-2-(4-methoxyphenyl)chromen-4-one
• Canonical SMILES: COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O
• InChI: InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)14-8-13(19)16-12(18)6-10(17)7-15(16)21-14/h2-8,17-18H,1H3
• InChI Key: DANYIYRPLHHOCZ-UHFFFAOYSA-N
• Boiling Point: 346.76 °C
• Melting Point: 260-265 °C (lit.)
• Density: 1.216 g/ml
• Appearance: Light yellow powder
• Hazard Statements: Xi
• pKa: 6.51±0.40
• Safety Description: 26-36
• Supplemental Hazard Statements: H315-H319-H335
• Symbol: GHS07

Custom Q&A

What is the molecular formula of Acacetin?

The molecular formula of Acacetin is C16H12O5.

What are the synonyms for Acacetin?

The synonyms for Acacetin include acacetin, Linarigenin, 5,7-Dihydroxy-4'-methoxyflavone, and 4'-Methoxyapigenin.

What is the molecular weight of Acacetin?

The molecular weight of Acacetin is 284.26 g/mol.

What is the IUPAC Name of Acacetin?

The IUPAC Name of Acacetin is 5,7-dihydroxy-2-(4-methoxyphenyl)chromen-4-one.

What is the InChI key of Acacetin?

The InChI key of Acacetin is DANYIYRPLHHOCZ-UHFFFAOYSA-N.

What is the Canonical SMILES of Acacetin?

The Canonical SMILES of Acacetin is COC1=CC=C(C=C1)C2=CC(=O)C3=C(C=C(C=C3O2)O)O.

What is the CAS number of Acacetin?

The CAS number of Acacetin is 480-44-4.

What is the XLogP3 value of Acacetin?

The XLogP3 value of Acacetin is 2.1.

How many hydrogen bond donor counts are there in Acacetin?

There are 2 hydrogen bond donor counts in Acacetin.

What is the exact mass of Acacetin?

The exact mass of Acacetin is 284.06847348 g/mol.

Synthetic Use

Downstream Synthesis Route 1

• 186581-53-3
• 480-44-4

• 5128-44-9

Reference: [1]Archiv der Pharmazie,1936,vol. 274,p. 126,136, 143

Downstream Synthesis Route 2

• 480-44-4
• 77-78-1

• 5128-44-9

Reference: [1]Proceedings - Indian Academy of Sciences, Section A,1949,p. 72,75
[2]Yakugaku Zasshi/Journal of the Pharmaceutical Society of Japan,1956,vol. 76,p. 453,454
Chem.Abstr.,1956,p. 16759

* For details of the synthesis route, please refer to the original source to ensure accuracy.