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296271-46-0 | 1-Propanone, 3-(4-chlorophenyl)-1-(3,4-dichlorophenyl)-
CAS No: 296271-46-0 Catalog No: AG002YX4 MDL No:
Product Description
Catalog Number:
AG002YX4
Chemical Name:
1-Propanone, 3-(4-chlorophenyl)-1-(3,4-dichlorophenyl)-
CAS Number:
296271-46-0
Molecular Formula:
C15H11Cl3O
Molecular Weight:
313.6062
IUPAC Name:
3-(4-chlorophenyl)-1-(3,4-dichlorophenyl)propan-1-one
InChI:
InChI=1S/C15H11Cl3O/c16-12-5-1-10(2-6-12)3-8-15(19)11-4-7-13(17)14(18)9-11/h1-2,4-7,9H,3,8H2
InChI Key:
TWAUQKNISTVTKD-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)CCC(=O)c1ccc(c(c1)Cl)Cl
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.988g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.602g/mol
Monoisotopic Mass:
311.988g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.4
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