Home Other Building Blocks [1,1'-Bicyclohexyl]-4-one, 4'-(4-methylphenyl)-, trans-

[1,1'-Bicyclohexyl]-4-one, 4'-(4-methylphenyl)-, trans-

CAS No.:
125962-80-3
Catalog Number:
AG000QLB
Molecular Formula:
C19H26O
Molecular Weight:
270.4091
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Product Description
Catalog Number:
AG000QLB
Chemical Name:
[1,1'-Bicyclohexyl]-4-one, 4'-(4-methylphenyl)-, trans-
CAS Number:
125962-80-3
Molecular Formula:
C19H26O
Molecular Weight:
270.4091
MDL Number:
MFCD13194928
IUPAC Name:
4-[4-(4-methylphenyl)cyclohexyl]cyclohexan-1-one
InChI:
InChI=1S/C19H26O/c1-14-2-4-15(5-3-14)16-6-8-17(9-7-16)18-10-12-19(20)13-11-18/h2-5,16-18H,6-13H2,1H3
InChI Key:
KPISRXVEAOLMIF-UHFFFAOYSA-N
SMILES:
O=C1CCC(CC1)[C@@H]1CC[C@H](CC1)c1ccc(cc1)C
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.198g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.416g/mol
Monoisotopic Mass:
270.198g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Properties