Chemical Properties of Scopoletin, O-pentafluoropropionyl-

Scopoletin, O-pentafluoropropionyl-

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InChI
InChI=1S/C13H7F5O5/c1-21-8-4-6-2-3-10(19)22-7(6)5-9(8)23-11(20)12(14,15)13(16,17)18/h2-5H,1H3
InChI Key
SZAQXVKWHIHWAK-UHFFFAOYSA-N
Formula
C13H7F5O5
SMILES
COc1cc2ccc(=O)oc2cc1OC(=O)C(F)(F)C(F)(F)F
Molecular Weight1
338.18
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Physical Properties

Property Value Unit Source
log10WS -8.26 Crippen Calculated Property
logPoct/wat 2.905 Crippen Calculated Property
McVol 184.710 ml/mol McGowan Calculated Property
Inp [1825.00; 1825.00]   Show Hide
Inp 1825.00 NIST
Inp 1825.00 NIST

Similar Compounds

Scopoletin, O-heptafluorobutyryl-. Scopoletin, O-trifluoroacetyl-. Scopoletin, O-acetyl-. Scoparone. 4-Hydroxycoumarin, pentafluoropropionate. Scopoletin. Scopoletin, trimethylsilyl ether. Scopoletin, tert-butyldimethylsilyl ether. Coumarin, 6-methoxy-7-trimethylsilyloxy. 2H-1-Benzopyran-2-one, 7-[(3,7-dimethyl-2,6-octadienyl)oxy]-, (E)-. 5-geranyloxy-7-methoxycoumarin. 5-isopentenyloxy-7-methoxycoumarin. neral oxypeucedaninyl acetal (diastereomer b). neral oxypeucedaninyl acetal (diastereomer a). geranial oxypeucedaninyl acetal (diastereomer a).

Find more compounds similar to Scopoletin, O-pentafluoropropionyl-.

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