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89449-71-8 | Isobenzofuran, 4,7-dimethoxy-1,3-diphenyl-
CAS No: 89449-71-8 Catalog No: AG0042W3 MDL No:
Product Description
Catalog Number:
AG0042W3
Chemical Name:
Isobenzofuran, 4,7-dimethoxy-1,3-diphenyl-
CAS Number:
89449-71-8
Molecular Formula:
C22H18O3
Molecular Weight:
330.3765
IUPAC Name:
4,7-dimethoxy-1,3-diphenyl-2-benzofuran
InChI:
InChI=1S/C22H18O3/c1-23-17-13-14-18(24-2)20-19(17)21(15-9-5-3-6-10-15)25-22(20)16-11-7-4-8-12-16/h3-14H,1-2H3
InChI Key:
GHZHBVJLVOLLEZ-UHFFFAOYSA-N
SMILES:
COc1ccc(c2c1c(oc2c1ccccc1)c1ccccc1)OC
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.126g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.383g/mol
Monoisotopic Mass:
330.126g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
31.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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