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126716-90-3 | Phenol, 4,4'-[1,3-phenylenebis(oxy)]bis-
CAS No: 126716-90-3 Catalog No: AG000T54 MDL No:MFCD00142505
Product Description
Catalog Number:
AG000T54
Chemical Name:
Phenol, 4,4'-[1,3-phenylenebis(oxy)]bis-
CAS Number:
126716-90-3
Molecular Formula:
C18H14O4
Molecular Weight:
294.3014
MDL Number:
MFCD00142505
IUPAC Name:
4-[3-(4-hydroxyphenoxy)phenoxy]phenol
InChI:
InChI=1S/C18H14O4/c19-13-4-8-15(9-5-13)21-17-2-1-3-18(12-17)22-16-10-6-14(20)7-11-16/h1-12,19-20H
InChI Key:
CJLPIPXJJJUBIV-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)Oc1cccc(c1)Oc1ccc(cc1)O
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.089g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
294.306g/mol
Monoisotopic Mass:
294.089g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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