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64145-51-3 | 3-Phenylcyclopentanone
CAS No: 64145-51-3 Catalog No: AG0039RA MDL No:MFCD00095000
Product Description
Catalog Number:
AG0039RA
Chemical Name:
3-Phenylcyclopentanone
CAS Number:
64145-51-3
Molecular Formula:
C11H12O
Molecular Weight:
160.2124
MDL Number:
MFCD00095000
IUPAC Name:
3-phenylcyclopentan-1-one
InChI:
InChI=1S/C11H12O/c12-11-7-6-10(8-11)9-4-2-1-3-5-9/h1-5,10H,6-8H2
InChI Key:
MFBXYJLOYZMFIN-UHFFFAOYSA-N
SMILES:
O=C1CCC(C1)c1ccccc1
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.089g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
160.216g/mol
Monoisotopic Mass:
160.089g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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