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18059-53-5 | Benzene, 1,1'-[2-butene-1,4-diylbis(oxy)]bis[4-chloro- (9CI)
CAS No: 18059-53-5 Catalog No: AG002255 MDL No:
Product Description
Catalog Number:
AG002255
Chemical Name:
Benzene, 1,1'-[2-butene-1,4-diylbis(oxy)]bis[4-chloro- (9CI)
CAS Number:
18059-53-5
Molecular Formula:
C16H14Cl2O2
Molecular Weight:
309.1872
IUPAC Name:
1-chloro-4-[4-(4-chlorophenoxy)but-2-enoxy]benzene
InChI:
InChI=1S/C16H14Cl2O2/c17-13-3-7-15(8-4-13)19-11-1-2-12-20-16-9-5-14(18)6-10-16/h1-10H,11-12H2
InChI Key:
CTLVUWCSVANYOV-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)OCC=CCOc1ccc(cc1)Cl
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.037g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
309.186g/mol
Monoisotopic Mass:
308.037g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
5.1
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