2-Acetyl-5-methylthiophene

Catalog	ACM13679748
CAS	13679-74-8
Structure
Synonyms	5-Methyl-2-acetylthiophene
IUPAC Name	1-(5-Methylthiophen-2-yl)ethanone
Molecular Weight	140.2
Molecular Formula	C7H8OS
Canonical SMILES	CC1=CC=C(S1)C(=O)C
InChI	InChI=1S/C7H8OS/c1-5-3-4-7(9-5)6(2)8/h3-4H,1-2H3
InChI Key	YOSDTJYMDAEEAZ-UHFFFAOYSA-N
Boiling Point	65-67 °C
Melting Point	24-28 °C
Flash Point	>230 °F
Purity	97%+
Density	1.106 g/mL at 25 °C(lit.)
Solubility	Very slightly soluble in water
Exact Mass	140.02958605
Monoisotopic Mass	140.02958605
Odor	Roasted aroma with sweet notes
Physical State	Powder or crystals
Refractive Index	n20/D 1.561(lit.)
Storage Conditions	Inert atmosphere,2-8 °C
Topological Polar Surface Area	45.3 Ų