(1S,5R,6S)-Ethyl 5-(pentan-3-yl-oxy)-7-oxa-bicyclo[4.1.0]hept-3-ene-3-carboxylate
Bezeichnung:(1S,5R,6S)-Ethyl 5-(pentan-3-yl-oxy)-7-oxa-bicyclo[4.1.0]hept-3-ene-3-carboxylate
CAS-Nr204254-96-6
Englisch Name:(1S,5R,6S)-Ethyl 5-(pentan-3-yl-oxy)-7-oxa-bicyclo[4.1.0]hept-3-ene-3-carboxylate
CBNumberCB1327357
SummenformelC14H22O4
Molgewicht254.32
MOL-Datei204254-96-6.mol
(1S,5R,6S)-Ethyl 5-(pentan-3-yl-oxy)-7-oxa-bicyclo[4.1.0]hept-3-ene-3-carboxylate physikalisch-chemischer Eigenschaften
Schmelzpunkt | 56-57°C |
Siedepunkt | 336.5±42.0 °C(Predicted) |
Dichte | 1.08±0.1 g/cm3(Predicted) |
storage temp. | Sealed in dry,Store in freezer, under -20°C |
Löslichkeit | Chloroform (Slightly), Methanol (Slightly) |
Aggregatzustand | Solid |
Farbe | White to Off-White |
InChI | InChI=1S/C14H22O4/c1-4-10(5-2)17-11-7-9(14(15)16-6-3)8-12-13(11)18-12/h7,10-13H,4-6,8H2,1-3H3/t11-,12+,13-/m1/s1 |
InChIKey | XZXCGRFGEVXWIT-FRRDWIJNSA-N |
SMILES | [C@]12([H])[C@]([H])(O1)[C@H](OC(CC)CC)C=C(C(OCC)=O)C2 |
CAS Datenbank | 204254-96-6(CAS DataBase Reference) |