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30305-71-6 | Hydroperoxide, cyclohexylphenyl (9CI)
CAS No: 30305-71-6 Catalog No: AG002ZLV MDL No:
Product Description
Catalog Number:
AG002ZLV
Chemical Name:
Hydroperoxide, cyclohexylphenyl (9CI)
CAS Number:
30305-71-6
Molecular Formula:
C12H16O2
Molecular Weight:
192.2542
IUPAC Name:
1-cyclohexyl-2-hydroperoxybenzene
InChI:
InChI=1S/C12H16O2/c13-14-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h4-5,8-10,13H,1-3,6-7H2
InChI Key:
YAQYQIOWYHHPAK-UHFFFAOYSA-N
SMILES:
OOc1ccccc1C1CCCCC1
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.258g/mol
Monoisotopic Mass:
192.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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