Home Other Building Blocks 4,4'-Bicyclohexanone

4,4'-Bicyclohexanone

CAS No.:
23391-99-3
Catalog Number:
AG002N27
Molecular Formula:
C12H18O2
Molecular Weight:
194.2701
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$32
- +
25g
95%
In Stock USA
United States
$94
- +
100g
95%
In Stock USA
United States
$244
- +
Product Description
Catalog Number:
AG002N27
Chemical Name:
4,4'-Bicyclohexanone
CAS Number:
23391-99-3
Molecular Formula:
C12H18O2
Molecular Weight:
194.2701
MDL Number:
MFCD00210694
IUPAC Name:
4-(4-oxocyclohexyl)cyclohexan-1-one
InChI:
InChI=1S/C12H18O2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h9-10H,1-8H2
InChI Key:
OQIDYCVWAFZRTR-UHFFFAOYSA-N
SMILES:
O=C1CCC(CC1)C1CCC(=O)CC1
EC Number:
607-226-4
NSC Number:
100201
Properties
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.131g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
194.274g/mol
Monoisotopic Mass:
194.131g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties