Home Other Building Blocks 2-methoxy-4-phenylcyclohexan-1-one

2-methoxy-4-phenylcyclohexan-1-one

CAS No.:
1803605-45-9
Catalog Number:
AG01B9MK
Molecular Formula:
C13H16O2
Molecular Weight:
204.2649
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Product Description
Catalog Number:
AG01B9MK
Chemical Name:
2-methoxy-4-phenylcyclohexan-1-one
CAS Number:
1803605-45-9
Molecular Formula:
C13H16O2
Molecular Weight:
204.2649
IUPAC Name:
2-methoxy-4-phenylcyclohexan-1-one
InChI:
InChI=1S/C13H16O2/c1-15-13-9-11(7-8-12(13)14)10-5-3-2-4-6-10/h2-6,11,13H,7-9H2,1H3
InChI Key:
BDWYLSNDWRACPH-UHFFFAOYSA-N
SMILES:
COC1CC(CCC1=O)c1ccccc1
Properties
Complexity:
219  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.115g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.269g/mol
Monoisotopic Mass:
204.115g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties