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Home Carboxys 4-(Trans,trans-4-butylcyclohexyl)phenyl 4'-propyl-[1,1'-bi(cyclohexane)]-4-carboxylate

4-(Trans,trans-4-butylcyclohexyl)phenyl 4'-propyl-[1,1'-bi(cyclohexane)]-4-carboxylate

CAS No.:
115978-59-1
Catalog Number:
AG000HA1
Molecular Formula:
C32H50O2
Molecular Weight:
466.7382
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
95%
In Stock USA
United States
$363
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Product Description
Catalog Number:
AG000HA1
Chemical Name:
4-(Trans,trans-4-butylcyclohexyl)phenyl 4'-propyl-[1,1'-bi(cyclohexane)]-4-carboxylate
CAS Number:
115978-59-1
Molecular Formula:
C32H50O2
Molecular Weight:
466.7382
MDL Number:
MFCD11053360
IUPAC Name:
[4-(4-butylcyclohexyl)phenyl] 4-(4-propylcyclohexyl)cyclohexane-1-carboxylate
InChI:
InChI=1S/C32H50O2/c1-3-5-7-25-10-14-27(15-11-25)29-20-22-31(23-21-29)34-32(33)30-18-16-28(17-19-30)26-12-8-24(6-4-2)9-13-26/h20-28,30H,3-19H2,1-2H3
InChI Key:
LCOGJPXBBIRCAF-UHFFFAOYSA-N
SMILES:
CCCC[C@@H]1CC[C@H](CC1)c1ccc(cc1)OC(=O)C1CCC(CC1)C1CCC(CC1)CCC
EC Number:
601-406-6
Properties
Complexity:
568  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
466.381g/mol
Formal Charge:
0
Heavy Atom Count:
34  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
466.75g/mol
Monoisotopic Mass:
466.381g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
12  
Properties