Loliolide

Datasheet MSDS
Catalog Number
ANC00042
Product Name
Loliolide
Structure
Loliolide
CAS Number
5989-02-6
IUPAC Name
(6S,7aR)-6-hydroxy-4,4,7a-trimethyl-6,7-dihydro-5H-1-benzofuran-2-one
Synonyms
loliolide; 5,6,7,7a-Tetrahydro-4,4,7aα-trimethyl-6α-hydroxybenzofuran-2(4H)-one; 5,6,7,7a-Tetrahydro-6α-hydroxy-4,4,7aα-trimethylbenzofuran-2(4H)-one; Digiprolactone; Caulilide; Loliolid; NSC289632; 2(4H)-Benzofuranone,5,6,7,7a-tetrahydro-6-hydroxy-4,4,7a-trimethyl-,(6S,7aR)-
Molecular Formula
C11H16O3
Molecular Weight
196.246
Appearance
Powder
Purity
0.98
Density
1.16±0.1g/cm3 (Predicted)
Melting Point
151-153°C
Boiling Point
352.7±42.0°C (Predicted)
SMILES
C[C@@]12C[C@H](CC(C1=CC(=O)O2)(C)C)O
InChI
InChI=1S/C11H16O3/c1-10(2)5-7(12)6-11(3)8(10)4-9(13)14-11/h4,7,12H,5-6H2,1-3H3/t7-,11+/m0/s1
InChI Key
XEVQXKKKAVVSMW-WRWORJQWSA-N
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