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88949-93-3 | Ethanone, 1,1'-[1,4-butanediylbis(oxy-4,1-phenylene)]bis[2-chloro-
CAS No: 88949-93-3 Catalog No: AG0047IM MDL No:
Product Description
Catalog Number:
AG0047IM
Chemical Name:
Ethanone, 1,1'-[1,4-butanediylbis(oxy-4,1-phenylene)]bis[2-chloro-
CAS Number:
88949-93-3
Molecular Formula:
C20H20Cl2O4
Molecular Weight:
395.2764
IUPAC Name:
2-chloro-1-[4-[4-[4-(2-chloroacetyl)phenoxy]butoxy]phenyl]ethanone
InChI:
InChI=1S/C20H20Cl2O4/c21-13-19(23)15-3-7-17(8-4-15)25-11-1-2-12-26-18-9-5-16(6-10-18)20(24)14-22/h3-10H,1-2,11-14H2
InChI Key:
GNCWUSCZCORQRA-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1ccc(cc1)OCCCCOc1ccc(cc1)C(=O)CCl
Properties
Complexity:
388
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
394.074g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
395.276g/mol
Monoisotopic Mass:
394.074g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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