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Home > Other Heterocycles > 648434-84-8
648434-84-8 | 7-Oxabicyclo[4.1.0]heptane, 3,3-bis[[(3-phenyl-2-propenyl)oxy]methyl]-
CAS No: 648434-84-8 Catalog No: AG006T64 MDL No:
Product Description
Catalog Number:
AG006T64
Chemical Name:
7-Oxabicyclo[4.1.0]heptane, 3,3-bis[[(3-phenyl-2-propenyl)oxy]methyl]-
CAS Number:
648434-84-8
Molecular Formula:
C26H30O3
Molecular Weight:
390.5146
IUPAC Name:
3,3-bis(3-phenylprop-2-enoxymethyl)-7-oxabicyclo[4.1.0]heptane
InChI:
InChI=1S/C26H30O3/c1-3-9-22(10-4-1)13-7-17-27-20-26(16-15-24-25(19-26)29-24)21-28-18-8-14-23-11-5-2-6-12-23/h1-14,24-25H,15-21H2
InChI Key:
IDFFWGSMPBLMBT-UHFFFAOYSA-N
SMILES:
C(C=Cc1ccccc1)OCC1(COCC=Cc2ccccc2)CCC2C(C1)O2
Properties
Complexity:
494
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
390.219g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
390.523g/mol
Monoisotopic Mass:
390.219g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
31A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
2
XLogP3:
4.9
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