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1443304-28-6 | 3,5-Dichlorophenyl cycloheptyl ketone
CAS No: 1443304-28-6 Catalog No: AG01FD48 MDL No:
Product Description
Catalog Number:
AG01FD48
Chemical Name:
3,5-Dichlorophenyl cycloheptyl ketone
CAS Number:
1443304-28-6
Molecular Formula:
C14H16Cl2O
Molecular Weight:
271.1822
IUPAC Name:
cycloheptyl-(3,5-dichlorophenyl)methanone
InChI:
InChI=1S/C14H16Cl2O/c15-12-7-11(8-13(16)9-12)14(17)10-5-3-1-2-4-6-10/h7-10H,1-6H2
InChI Key:
BOZGDNZRGSRZDE-UHFFFAOYSA-N
SMILES:
O=C(c1cc(Cl)cc(c1)Cl)C1CCCCCC1
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.058g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.181g/mol
Monoisotopic Mass:
270.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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