In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 25 | Yes |
Popular Name: 9-((3,7-Dimethylocta-2,6-dien-1-yl)oxy)-7H-furo[3,2-g]chromen-7-one 9-((3,7-Dimethylocta-2,6-dien-1-…
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CAS Numbers: 7437-55-0 , [7437-55-0]
8-Geranyloxy Psoralen;8-Geranyloxypsoralen;9-Geranyloxypsoralen;Xanthotoxol geranyl ether
9-((3,7-Dimethylocta-2,6-dien-1-yl)-oxy)-7H-furo[3,2-g]chromen-7-one
9-[(3,7-Dimethyl-2,6-octadienyl)oxy]-7H-furo[3,2-g][1]benzopyran-7-one
Xanthotoxol Geranyl Ether [7437-55-0]; (8-Geranyloxypsoralen)
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 5.80 | 12.59 | -17.09 | 0 | 4 | 0 | 53 | 338.403 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
M.P | 54-56C | Indofine |
MP | 54-56o C | Indofine |
Purity | 95% | Fluorochem |
SOLUBILITY | Soluble in Chloroform | Indofine |
APPEARANCE | Tan color powder | Indofine |