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115169-77-2 | Cyclopentanone, 3-(4-chlorophenyl)-
CAS No: 115169-77-2 Catalog No: AG000GCJ MDL No:MFCD06659804
Product Description
Catalog Number:
AG000GCJ
Chemical Name:
Cyclopentanone, 3-(4-chlorophenyl)-
CAS Number:
115169-77-2
Molecular Formula:
C11H11ClO
Molecular Weight:
194.6574
MDL Number:
MFCD06659804
IUPAC Name:
3-(4-chlorophenyl)cyclopentan-1-one
InChI:
InChI=1S/C11H11ClO/c12-10-4-1-8(2-5-10)9-3-6-11(13)7-9/h1-2,4-5,9H,3,6-7H2
InChI Key:
ACPYGZVNDNYVPM-UHFFFAOYSA-N
SMILES:
O=C1CCC(C1)c1ccc(cc1)Cl
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.05g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.658g/mol
Monoisotopic Mass:
194.05g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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