4-Hydroxy-3-methoxyphenylacetone

• CAS: 2503-46-0
• Catalog Number: ACM2503460
• Category: Other Products
• Molecular Weight: 180.2
• Molecular Formula: C₁₀H₁₂O₃
• Synonyms: 1-(4-Hydroxyphenyl)-1-methoxy-2-propanone
• IUPAC Name: 1-(4-Hydroxy-3-methoxyphenyl)propan-2-one
• SMILES: CC(=O)CC1=CC(=C(C=C1)O)OC
• InChI: InChI=1S/C10H12O3/c1-7(11)5-8-3-4-9(12)10(6-8)13-2/h3-4,6,12H,5H2,1-2H3
• InChI Key: LFVCJQWZGDLHSD-UHFFFAOYSA-N
• Boiling Point: 126-127 °C
• Flash Point: >230 °F
• Density: 1.163 g/mL at 25 °C(lit.)
• Solubility: Soluble in alcohol and water
• Exact Mass: 180.078644241
• Hazard Statements: Xi
• Monoisotopic Mass: 180.078644241
• Refractive Index: n20/D 1.55(lit.)
• Safety Description: 26-36
• Storage Conditions: Dry place,Room Temperature
• Supplemental Hazard Statements: H315-H319-H335
• Symbol: GHS07
• Topological Polar Surface Area: 46.5 Ų

Custom Q&A

What is the molecular formula of 4-Hydroxy-3-methoxyphenylacetone?

The molecular formula of 4-Hydroxy-3-methoxyphenylacetone is C10H12O3.

When was the structure of 4-Hydroxy-3-methoxyphenylacetone last modified?

The structure of 4-Hydroxy-3-methoxyphenylacetone was last modified on 2023-12-30.

What is the IUPAC name of 4-Hydroxy-3-methoxyphenylacetone?

The IUPAC name of 4-Hydroxy-3-methoxyphenylacetone is 1-(4-hydroxy-3-methoxyphenyl)propan-2-one.

What is the InChIKey of 4-Hydroxy-3-methoxyphenylacetone?

The InChIKey of 4-Hydroxy-3-methoxyphenylacetone is LFVCJQWZGDLHSD-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 4-Hydroxy-3-methoxyphenylacetone have?

4-Hydroxy-3-methoxyphenylacetone has 1 hydrogen bond donor count.

What is the topological polar surface area of 4-Hydroxy-3-methoxyphenylacetone?

The topological polar surface area of 4-Hydroxy-3-methoxyphenylacetone is 46.5 Ų.

What is the molecular weight of 4-Hydroxy-3-methoxyphenylacetone?

The molecular weight of 4-Hydroxy-3-methoxyphenylacetone is 180.20 g/mol.

What is the canonical SMILES representation of 4-Hydroxy-3-methoxyphenylacetone?

The canonical SMILES representation of 4-Hydroxy-3-methoxyphenylacetone is CC(=O)CC1=CC(=C(C=C1)O)OC.

What is the UNII number of 4-Hydroxy-3-methoxyphenylacetone?

The UNII number of 4-Hydroxy-3-methoxyphenylacetone is 0626DKI6FE.

How many heavy atoms does 4-Hydroxy-3-methoxyphenylacetone contain?

4-Hydroxy-3-methoxyphenylacetone contains 13 heavy atoms.