![[1,1'-Biphenyl]-4-carboxylic acid (3aR,4R,5R,6aS)-hexahydro-2-oxo-4-[(1E)-3-oxo-4-[3-(trifluoromethyl)phenoxy]-1-buten-1-yl]-2H-cyclopenta[b]furan-5-yl ester structure, CAS 54142-64-2](/structures/60000/44139_2_54142_64_2.png)
CAS Number54142-64-2
Synonyms(3ar,4as,8ar,9ar)-8a-methyl-3,5-dimethylene-decahydro-naphtho[2,3-b]furan-2-one; (3aR,4aS,8aR,9aR)-decahydro-8a-methyl-3,5-dimethylidenenaphtho[2,3-b]furan-2(3H)-one; ISOALANTOLACTONE (RG); ISOHELENIN; ISOALANTOACTONE; Naphtho[2,3-b]furan-2(3H)-one,decahydro-8a; methyl-3,5-bis(methylene)-,(3aR,4aS,8aR,9aR); isolantolactone
Molecular FormulaC31H25F3O6
Molecular Weight550.522
Purity98.00%
Density1.4±0.1 g/cm3
Boiling Point699.7±55.0 °C at 760 mmHg
Melting Point128-129ºC
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 54142-64-2 |
| Catalog No. | 2A-9044139 |
| Chinese Name | (3aR,4R,5R,6aS)-六氢-2-氧代-4-[(1E)-3-氧代-4-[3-(三氟甲基)苯氧基]-1-丁烯-1-基]-2H-环戊并[b]呋喃-5-基 [1,1'-联苯]-4-甲酸酯 |
| Synonyms | (3ar,4as,8ar,9ar)-8a-methyl-3,5-dimethylene-decahydro-naphtho[2,3-b]furan-2-one; (3aR,4aS,8aR,9aR)-decahydro-8a-methyl-3,5-dimethylidenenaphtho[2,3-b]furan-2(3H)-one; ISOALANTOLACTONE (RG); ISOHELENIN; ISOALANTOACTONE; Naphtho[2,3-b]furan-2(3H)-one,decahydro-8a; methyl-3,5-bis(methylene)-,(3aR,4aS,8aR,9aR); isolantolactone |
| Molecular Formula | C31H25F3O6 |
| Molecular Weight | 550.522 |
| Purity | 98.00 |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 699.7±55.0 °C at 760 mmHg |
| Melting Point | 128-129ºC |
| PubChem ID | 16960191 |
| SMILES | O=C(C=CC1C(OC(=O)c2ccc(-c3ccccc3)cc2)CC2OC(=O)CC21)COc1cccc(C(F)(F)F)c1 |
| InChI | InChI=1S/C31H25F3O6/c32-31(33,34)22-7-4-8-24(15-22)38-18-23(35)13-14-25-26-16-29(36)39-28(26)17-27(25)40-30(37)21-11-9-20(10-12-21)19-5-2-1-3-6-19/h1-15,25-28H,16-18H2/b14-13+/t25-,26-,27-,28+/m1/s1 |
| InChI Key | FLEHAOYBYPJWKG-HPQIJTKRSA-N |
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