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1638-12-6 | Benzene, 1,3-bis(4-phenoxyphenoxy)-
CAS No: 1638-12-6 Catalog No: AG001UEA MDL No:
Product Description
Catalog Number:
AG001UEA
Chemical Name:
Benzene, 1,3-bis(4-phenoxyphenoxy)-
CAS Number:
1638-12-6
Molecular Formula:
C30H22O4
Molecular Weight:
446.4933
IUPAC Name:
1,3-bis(4-phenoxyphenoxy)benzene
InChI:
InChI=1S/C30H22O4/c1-3-8-23(9-4-1)31-25-14-18-27(19-15-25)33-29-12-7-13-30(22-29)34-28-20-16-26(17-21-28)32-24-10-5-2-6-11-24/h1-22H
InChI Key:
KYSKNYFGWVBAOD-UHFFFAOYSA-N
SMILES:
c1cc(cc(c1)Oc1ccc(cc1)Oc1ccccc1)Oc1ccc(cc1)Oc1ccccc1
EC Number:
216-669-9
Properties
Complexity:
506
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
446.152g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
446.502g/mol
Monoisotopic Mass:
446.152g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
8
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