CAS
64835-30-9 Purity
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64835-30-9 Purity
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4-((2-Furylmethyl)thio)-4-methylpentan-2-one
CAS
64835-96-7
Catalog Number
ACM64835967
Category
Other Products
Molecular Weight
212.31
Molecular Formula
C11H16O2S
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Specification
Synonyms
4-(Furfurylthio)-4-methyl-2-pentanone
IUPAC Name
4-(Furan-2-ylmethylsulfanyl)-4-methylpentan-2-one
Canonical SMILES
CC(=O)CC(C)(C)SCC1=CC=CO1
InChI
InChI=1S/C11H16O2S/c1-9(12)7-11(2,3)14-8-10-5-4-6-13-10/h4-6H,7-8H2,1-3H3
InChI Key
NTTNPAOBBWQSPN-UHFFFAOYSA-N
Boiling Point
298.7±25.0 °C
Density
1.068±0.06 g/cm³
Exact Mass
212.08710092
Monoisotopic Mass
212.08710092
Topological Polar Surface Area
55.5 Ų
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