2-Mercaptomethylpyrazine

CAS	59021-02-2
Structure
Synonyms	2-Pyrazinemethanethiol
IUPAC Name	Pyrazin-2-ylmethanethiol
Molecular Weight	126.18
Canonical SMILES	C1=CN=C(C=N1)CS
InChI	InChI=1S/C5H6N2S/c8-4-5-3-6-1-2-7-5/h1-3,8H,4H2
InChI Key	VQFGDOHENLRPFB-UHFFFAOYSA-N
Boiling Point	224.8±25.0 °C
Purity	95%+
Density	1.187±0.06 g/cm³
Solubility	Soluble in water, organic solvents, oils
Exact Mass	126.02516937
Monoisotopic Mass	126.02516937
Odor	Roasted, meat-like odor
Physical State	Liquid
Refractive Index	n20/D 1.548-1.560(lit.)
Topological Polar Surface Area	26.8 Ų