Home Other Building Blocks 3-methyl-3-phenylcyclopentan-1-one

3-methyl-3-phenylcyclopentan-1-one

CAS No.:
53750-06-4
Catalog Number:
AG01AG0W
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
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Product Description
Catalog Number:
AG01AG0W
Chemical Name:
3-methyl-3-phenylcyclopentan-1-one
CAS Number:
53750-06-4
Molecular Formula:
C12H14O
Molecular Weight:
174.2390
MDL Number:
MFCD24688212
IUPAC Name:
3-methyl-3-phenylcyclopentan-1-one
InChI:
InChI=1S/C12H14O/c1-12(8-7-11(13)9-12)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
InChI Key:
RGOAWKBPBSKZML-UHFFFAOYSA-N
SMILES:
O=C1CCC(C1)(C)c1ccccc1
Properties
Complexity:
203  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.104g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.243g/mol
Monoisotopic Mass:
174.104g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties