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123389-00-4 | Benzene, 1,1'-(1-methylethylidene)bis[4-[(1,2-dichloroethenyl)oxy]-
CAS No: 123389-00-4 Catalog No: AG000KHO MDL No:
Product Description
Catalog Number:
AG000KHO
Chemical Name:
Benzene, 1,1'-(1-methylethylidene)bis[4-[(1,2-dichloroethenyl)oxy]-
CAS Number:
123389-00-4
Molecular Formula:
C19H16Cl4O2
Molecular Weight:
418.1411
IUPAC Name:
1-(1,2-dichloroethenoxy)-4-[2-[4-(1,2-dichloroethenoxy)phenyl]propan-2-yl]benzene
InChI:
InChI=1S/C19H16Cl4O2/c1-19(2,13-3-7-15(8-4-13)24-17(22)11-20)14-5-9-16(10-6-14)25-18(23)12-21/h3-12H,1-2H3
InChI Key:
XNGUQHNUBRTFPV-UHFFFAOYSA-N
SMILES:
ClC=C(Oc1ccc(cc1)C(c1ccc(cc1)OC(=CCl)Cl)(C)C)Cl
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
417.987g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
418.135g/mol
Monoisotopic Mass:
415.99g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
7.9
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