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102573-57-9 | Phenol, 4,4'-(phenylethenylidene)bis-, diacetate (9CI)
CAS No: 102573-57-9 Catalog No: AG0007SP MDL No:
Product Description
Catalog Number:
AG0007SP
Chemical Name:
Phenol, 4,4'-(phenylethenylidene)bis-, diacetate (9CI)
CAS Number:
102573-57-9
Molecular Formula:
C24H24O6
Molecular Weight:
408.4438
IUPAC Name:
acetic acid;4-[1-(4-hydroxyphenyl)-2-phenylethenyl]phenol
InChI:
InChI=1S/C20H16O2.2C2H4O2/c21-18-10-6-16(7-11-18)20(14-15-4-2-1-3-5-15)17-8-12-19(22)13-9-17;2*1-2(3)4/h1-14,21-22H;2*1H3,(H,3,4)
InChI Key:
FUEHQAFGSKHXIR-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C(=Cc1ccccc1)c1ccc(cc1)O.CC(=O)O.CC(=O)O
Properties
Complexity:
361
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
408.157g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
408.45g/mol
Monoisotopic Mass:
408.157g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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