200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 77061-52-0
77061-52-0 | Peroxide, 1,1-dimethylethyl 3,3,5-trimethylcyclohexyl
CAS No: 77061-52-0 Catalog No: AG005EFW MDL No:
Product Description
Catalog Number:
AG005EFW
Chemical Name:
Peroxide, 1,1-dimethylethyl 3,3,5-trimethylcyclohexyl
CAS Number:
77061-52-0
Molecular Formula:
C13H26O2
Molecular Weight:
214.3443
IUPAC Name:
3-tert-butylperoxy-1,1,5-trimethylcyclohexane
InChI:
InChI=1S/C13H26O2/c1-10-7-11(9-13(5,6)8-10)14-15-12(2,3)4/h10-11H,7-9H2,1-6H3
InChI Key:
OXGOEZHUKDEEKS-UHFFFAOYSA-N
SMILES:
CC1CC(OOC(C)(C)C)CC(C1)(C)C
Properties
Complexity:
203
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.193g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
214.349g/mol
Monoisotopic Mass:
214.193g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.