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15592-50-4 | 1,2,4-Trioxolane, 3,3,5,5-tetramethyl-
CAS No: 15592-50-4 Catalog No: AG001OD8 MDL No:
Product Description
Catalog Number:
AG001OD8
Chemical Name:
1,2,4-Trioxolane, 3,3,5,5-tetramethyl-
CAS Number:
15592-50-4
Molecular Formula:
C6H12O3
Molecular Weight:
132.1577
IUPAC Name:
3,3,5,5-tetramethyl-1,2,4-trioxolane
InChI:
InChI=1S/C6H12O3/c1-5(2)7-6(3,4)9-8-5/h1-4H3
InChI Key:
AFVLYDOYMBNGDE-UHFFFAOYSA-N
SMILES:
CC1(C)OOC(O1)(C)C
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
132.159g/mol
Monoisotopic Mass:
132.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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