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cyclopentyl(4-methylphenyl)methanone

CAS No.:
97802-97-6
Catalog Number:
AG01AFYM
Molecular Formula:
C13H16O
Molecular Weight:
188.2655
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Product Description
Catalog Number:
AG01AFYM
Chemical Name:
cyclopentyl(4-methylphenyl)methanone
CAS Number:
97802-97-6
Molecular Formula:
C13H16O
Molecular Weight:
188.2655
MDL Number:
MFCD03841293
IUPAC Name:
cyclopentyl-(4-methylphenyl)methanone
InChI:
InChI=1S/C13H16O/c1-10-6-8-12(9-7-10)13(14)11-4-2-3-5-11/h6-9,11H,2-5H2,1H3
InChI Key:
ATPGKQPKLIKHTF-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)C)C1CCCC1
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.12g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
188.27g/mol
Monoisotopic Mass:
188.12g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties