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6-(4-methoxyphenoxy)-2-phenyl-8-(prop-2-en-1-yloxy)-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-7-yl acetate

6-(4-methoxyphenoxy)-2-phenyl-8-(prop-2-en-1-yloxy)-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-7-yl acetate

CAS: 1477956-18-5

Formula: C25H28O8

SMILES: COC1=CC=C(OC2OC3COC(OC3C(OCC=C)C2OC(C)=O)C2=CC=CC=C2)C=C1

IUPAC: 6-(4-methoxyphenoxy)-2-phenyl-8-(prop-2-en-1-yloxy)-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-7-yl acetate

InChI: InChI=1/C25H28O8/c1-4-14-28-22-21-20(15-29-24(33-21)17-8-6-5-7-9-17)32-25(23(22)30-16(2)26)31-19-12-10-18(27-3)11-13-19/h4-13,20-25H,1,14-15H2,2-3H3

Composition: C (65.78%), H (6.18%), O (28.04%)

Molar Mass: 456.491

Atom Count: 61

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 6
Exact Mass 456.178417862
Formal Charge 0
FSP3 0.4
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 7
Hydrogen Bond Donor Count 0
InChIKey AYSHRBCEMWANHR-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 116.6
Topological Polar Surface Area 81.68
Polarizability 47.08
Ring Count 4
Rotatable Bond Count 9

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Purity LeadTime CAS UnitPrice
98% <10 Days 1477956-18-5 Quote Only
Molecule Market Select
Purity LeadTime CAS UnitPrice
98% <14 Days 1477956-18-5 Quote Only