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129644-20-8 | Ethanone, 1-[4-(4-chloro-3-methylphenoxy)phenyl]-
CAS No: 129644-20-8 Catalog No: AG000Z9A MDL No:
Product Description
Catalog Number:
AG000Z9A
Chemical Name:
Ethanone, 1-[4-(4-chloro-3-methylphenoxy)phenyl]-
CAS Number:
129644-20-8
Molecular Formula:
C15H13ClO2
Molecular Weight:
260.7155
IUPAC Name:
1-[4-(4-chloro-3-methylphenoxy)phenyl]ethanone
InChI:
InChI=1S/C15H13ClO2/c1-10-9-14(7-8-15(10)16)18-13-5-3-12(4-6-13)11(2)17/h3-9H,1-2H3
InChI Key:
CLZLXIBVWOGERP-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc(cc1)Oc1ccc(c(c1)C)Cl
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.06g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.717g/mol
Monoisotopic Mass:
260.06g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
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