| Catalog |
ACM136954217 |
| CAS |
136954-21-7 |
| Structure |  |
| Synonyms |
Butanoic acid, 3-mercaptohexyl ester |
| IUPAC Name |
3-Sulfanylhexyl butanoate |
| Molecular Weight |
204.33 |
| Molecular Formula |
C10H20O2S |
| Canonical SMILES |
CCCC(CCOC(=O)CCC)S |
| InChI |
InChI=1S/C10H20O2S/c1-3-5-9(13)7-8-12-10(11)6-4-2/h9,13H,3-8H2,1-2H3 |
| InChI Key |
TZNJKOLXWHXDAF-UHFFFAOYSA-N |
| Boiling Point |
272.9±23.0 °C |
| Purity |
95%+ |
| Density |
0.966±0.06 g/cm³ |
| Solubility |
Insoluble in water; soluble in ethanol and heptane |
| Exact Mass |
204.11840105 |
| Monoisotopic Mass |
204.11840105 |
| Physical State |
Liquid |
| Refractive Index |
n20/D 1.459-1.469(lit.) |
| Topological Polar Surface Area |
27.3 Ų |
For Research Use Only. Not for use in diagnostic or therapeutic procedures.
