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102580-68-7 | Ethanone, 1-(4-chlorophenyl)-2-cyclopentyl-
CAS No: 102580-68-7 Catalog No: AG0007SY MDL No:
Product Description
Catalog Number:
AG0007SY
Chemical Name:
Ethanone, 1-(4-chlorophenyl)-2-cyclopentyl-
CAS Number:
102580-68-7
Molecular Formula:
C13H15ClO
Molecular Weight:
222.7106
IUPAC Name:
1-(4-chlorophenyl)-2-cyclopentylethanone
InChI:
InChI=1S/C13H15ClO/c14-12-7-5-11(6-8-12)13(15)9-10-3-1-2-4-10/h5-8,10H,1-4,9H2
InChI Key:
IHDMFJNSDRBTBX-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)Cl)CC1CCCC1
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.081g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.712g/mol
Monoisotopic Mass:
222.081g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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