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24493-26-3 | Cyclohexanone, 2-(2,5-dimethylphenoxy)-
CAS No: 24493-26-3 Catalog No: AG002OB9 MDL No:
Product Description
Catalog Number:
AG002OB9
Chemical Name:
Cyclohexanone, 2-(2,5-dimethylphenoxy)-
CAS Number:
24493-26-3
Molecular Formula:
C14H18O2
Molecular Weight:
218.2915
IUPAC Name:
2-(2,5-dimethylphenoxy)cyclohexan-1-one
InChI:
InChI=1S/C14H18O2/c1-10-7-8-11(2)14(9-10)16-13-6-4-3-5-12(13)15/h7-9,13H,3-6H2,1-2H3
InChI Key:
LUSJBHWUQKGICP-UHFFFAOYSA-N
SMILES:
O=C1CCCCC1Oc1cc(C)ccc1C
NSC Number:
109518
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.131g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.296g/mol
Monoisotopic Mass:
218.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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