Cas no 647032-75-5 ((3aS,4R,7R,7aS)-Decahydro-1a,4-dimethyl-α-methylenenaphth[1,2-b]oxirene-7-acetic acid)

(3aS,4R,7R,7aS)-Decahydro-1a,4-dimethyl-α-methylenenaphth[1,2-b]oxirene-7-acetic acid structure
647032-75-5 structure
Product Name:(3aS,4R,7R,7aS)-Decahydro-1a,4-dimethyl-α-methylenenaphth[1,2-b]oxirene-7-acetic acid
CAS No:647032-75-5
MF:C15H22O3
MW:250.333384990692
CID:6637802
Update Time:2024-01-15

(3aS,4R,7R,7aS)-Decahydro-1a,4-dimethyl-α-methylenenaphth[1,2-b]oxirene-7-acetic acid Chemical and Physical Properties

Names and Identifiers

    • (3aS,4R,7R,7aS)-Decahydro-1a,4-dimethyl-α-methylenenaphth[1,2-b]oxirene-7-acetic acid
    • Inchi: 1S/C15H22O3/c1-8-4-5-11(9(2)14(16)17)12-10(8)6-7-15(3)13(12)18-15/h8,10-13H,2,4-7H2,1,3H3,(H,16,17)/t8-,10+,11+,12+,13?,15?/m1/s1
    • InChI Key: CQNNGKUJKJXDCO-SAXWWSJFSA-N
    • SMILES: O1C2(C)CC[C@]3([H])[C@]([H])(C12)[C@H](C(=C)C(O)=O)CC[C@H]3C

Experimental Properties

  • Density: 1.121±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)
  • Boiling Point: 396.4±15.0 °C(Predicted)
  • pka: 4.32±0.11(Predicted)
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