200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 85981-79-9
85981-79-9 | Hydroperoxide, 1,1-dimethyl-3-(2,4,6-trimethylphenyl)butyl
CAS No: 85981-79-9 Catalog No: AG004M6P MDL No:
Product Description
Catalog Number:
AG004M6P
Chemical Name:
Hydroperoxide, 1,1-dimethyl-3-(2,4,6-trimethylphenyl)butyl
CAS Number:
85981-79-9
Molecular Formula:
C15H24O2
Molecular Weight:
236.3499
IUPAC Name:
2-(4-hydroperoxy-4-methylpentan-2-yl)-1,3,5-trimethylbenzene
InChI:
InChI=1S/C15H24O2/c1-10-7-11(2)14(12(3)8-10)13(4)9-15(5,6)17-16/h7-8,13,16H,9H2,1-6H3
InChI Key:
HYXDONSRMNQHNX-UHFFFAOYSA-N
SMILES:
OOC(CC(c1c(C)cc(cc1C)C)C)(C)C
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.178g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.355g/mol
Monoisotopic Mass:
236.178g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.