4176-97-0

Name 3-[2-[(1R,4aβ)-2-Methylene-5α-(hydroxymethyl)-5,8aα-dimethyl-6α-hydroxydecalin-1α-yl]ethyl]-2,5-dihydrofuran-2-one
CAS 4176-97-0
EINECS(EC#) 2017-001-1
Molecular Formula C20H30O4
MDL Number MFCD01861504
Molecular Weight 334.45
MOL File 4176-97-0.mol
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Chemical Properties

Melting point  176-178℃
Boiling point  509.5±50.0 °C(Predicted)
density  1.15
storage temp.  Store at -20°C
solubility  Acetonitrile: soluble
form  A solid
pka 14.89±0.70(Predicted)
color  White to off-white
InChI InChI=1S/C20H30O4/c1-13-4-7-16-19(2,10-8-17(22)20(16,3)12-21)15(13)6-5-14-9-11-24-18(14)23/h9,15-17,21-22H,1,4-8,10-12H2,2-3H3/t15-,16+,17-,19+,20+/m1/s1
InChIKey GVRNTWSGBWPJGS-YSDSKTICSA-N
SMILES O1CC=C(CC[C@H]2[C@@]3(C)[C@@]([H])([C@@](CO)(C)[C@H](O)CC3)CCC2=C)C1=O

Safety Data

WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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