3-(Methylthio)propyl acetate

Catalog	ACM16630550
CAS	16630-55-0
Structure
Synonyms	Acetic acid 3-(methylthio)propyl ester
IUPAC Name	3-Methylsulfanylpropyl acetate
Molecular Weight	148.23
Molecular Formula	C6H12O2S
Canonical SMILES	CC(=O)OCCCSC
InChI	InChI=1S/C6H12O2S/c1-6(7)8-4-3-5-9-2/h3-5H2,1-2H3
InChI Key	LPZQTNIAYMRVMF-UHFFFAOYSA-N
Boiling Point	96 °C
Purity	95%+
Density	1.041 g/cm³
Solubility	Very slightly soluble in water; soluble in alcohol and oils
Exact Mass	148.05580079
Monoisotopic Mass	148.05580079
Odor	Fatty, estery odor
Physical State	Liquid
Refractive Index	n20/D 1.4610-1.4650(lit.)
Topological Polar Surface Area	51.6 Ų