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144026-55-1 | 1,2-Dioxetane, 3,3-bis(1-methylethyl)-
CAS No: 144026-55-1 Catalog No: AG001ISU MDL No:
Product Description
Catalog Number:
AG001ISU
Chemical Name:
1,2-Dioxetane, 3,3-bis(1-methylethyl)-
CAS Number:
144026-55-1
Molecular Formula:
C8H16O2
Molecular Weight:
144.2114
IUPAC Name:
3,3-di(propan-2-yl)dioxetane
InChI:
InChI=1S/C8H16O2/c1-6(2)8(7(3)4)5-9-10-8/h6-7H,5H2,1-4H3
InChI Key:
URVKCTMOWQXEOP-UHFFFAOYSA-N
SMILES:
CC(C1(COO1)C(C)C)C
Properties
Complexity:
110
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
144.115g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
144.214g/mol
Monoisotopic Mass:
144.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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