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17355-89-4 | Hydroperoxide, 1-methyl-1-(2-naphthalenyl)ethyl
CAS No: 17355-89-4 Catalog No: AG001Z0X MDL No:
Product Description
Catalog Number:
AG001Z0X
Chemical Name:
Hydroperoxide, 1-methyl-1-(2-naphthalenyl)ethyl
CAS Number:
17355-89-4
Molecular Formula:
C13H14O2
Molecular Weight:
202.2491
IUPAC Name:
2-(2-hydroperoxypropan-2-yl)naphthalene
InChI:
InChI=1S/C13H14O2/c1-13(2,15-14)12-8-7-10-5-3-4-6-11(10)9-12/h3-9,14H,1-2H3
InChI Key:
TWIWXQHFJXKAPK-UHFFFAOYSA-N
SMILES:
OOC(c1ccc2c(c1)cccc2)(C)C
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.099g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.253g/mol
Monoisotopic Mass:
202.099g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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