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22321-84-2 | Hydroperoxide, 6,6-dimethyl-2-methylenebicyclo[3.1.1]hept-3-yl
CAS No: 22321-84-2 Catalog No: AG006YVT MDL No:
Product Description
Catalog Number:
AG006YVT
Chemical Name:
Hydroperoxide, 6,6-dimethyl-2-methylenebicyclo[3.1.1]hept-3-yl
CAS Number:
22321-84-2
Molecular Formula:
C10H16O2
Molecular Weight:
168.2328
IUPAC Name:
3-hydroperoxy-6,6-dimethyl-2-methylidenebicyclo[3.1.1]heptane
InChI:
InChI=1S/C10H16O2/c1-6-8-4-7(10(8,2)3)5-9(6)12-11/h7-9,11H,1,4-5H2,2-3H3
InChI Key:
UQHVOBUXTHVSBI-UHFFFAOYSA-N
SMILES:
OOC1CC2CC(C1=C)C2(C)C
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.236g/mol
Monoisotopic Mass:
168.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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