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832128-21-9 | 4-Benzofuranol, 6-[(1Z)-2-(3,5-dimethoxyphenyl)ethenyl]-
CAS No: 832128-21-9 Catalog No: AG004UML MDL No:
Product Description
Catalog Number:
AG004UML
Chemical Name:
4-Benzofuranol, 6-[(1Z)-2-(3,5-dimethoxyphenyl)ethenyl]-
CAS Number:
832128-21-9
Molecular Formula:
C18H16O4
Molecular Weight:
296.3172
IUPAC Name:
6-[2-(3,5-dimethoxyphenyl)ethenyl]-1-benzofuran-4-ol
InChI:
InChI=1S/C18H16O4/c1-20-14-7-12(8-15(11-14)21-2)3-4-13-9-17(19)16-5-6-22-18(16)10-13/h3-11,19H,1-2H3
InChI Key:
CIAUAUMFFDERFG-UHFFFAOYSA-N
SMILES:
COc1cc(/C=C\c2cc(O)c3c(c2)occ3)cc(c1)OC
Properties
Complexity:
371
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.105g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.322g/mol
Monoisotopic Mass:
296.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.2
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