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85604-65-5 | 2H-Pyran, 2-[2,6-dimethoxy-4-(2-propenyl)phenoxy]tetrahydro-
CAS No: 85604-65-5 Catalog No: AG004U52 MDL No:
Product Description
Catalog Number:
AG004U52
Chemical Name:
2H-Pyran, 2-[2,6-dimethoxy-4-(2-propenyl)phenoxy]tetrahydro-
CAS Number:
85604-65-5
Molecular Formula:
C16H22O4
Molecular Weight:
278.3435
IUPAC Name:
2-(2,6-dimethoxy-4-prop-2-enylphenoxy)oxane
InChI:
InChI=1S/C16H22O4/c1-4-7-12-10-13(17-2)16(14(11-12)18-3)20-15-8-5-6-9-19-15/h4,10-11,15H,1,5-9H2,2-3H3
InChI Key:
UPUIHIJSMVWLAQ-UHFFFAOYSA-N
SMILES:
C=CCc1cc(OC)c(c(c1)OC)OC1CCCCO1
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.152g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.348g/mol
Monoisotopic Mass:
278.152g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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