Home Other Building Blocks 3-CYCLOHEXYLCYCLOHEXAN-1-ONE

3-CYCLOHEXYLCYCLOHEXAN-1-ONE

CAS No.:
7122-93-2
Catalog Number:
AG01BNN6
Molecular Formula:
C12H20O
Molecular Weight:
180.2866
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Product Description
Catalog Number:
AG01BNN6
Chemical Name:
3-CYCLOHEXYLCYCLOHEXAN-1-ONE
CAS Number:
7122-93-2
Molecular Formula:
C12H20O
Molecular Weight:
180.2866
MDL Number:
MFCD20336461
IUPAC Name:
3-cyclohexylcyclohexan-1-one
InChI:
InChI=1S/C12H20O/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10/h10-11H,1-9H2
InChI Key:
CANCZANBFBDGQT-UHFFFAOYSA-N
SMILES:
O=C1CCCC(C1)C1CCCCC1
Properties
Complexity:
180  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.151g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.291g/mol
Monoisotopic Mass:
180.151g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties