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17742-79-9 | Methanol, 1-[(1,1-dimethylpropyl)dioxy]-
CAS No: 17742-79-9 Catalog No: AG0025BF MDL No:
Product Description
Catalog Number:
AG0025BF
Chemical Name:
Methanol, 1-[(1,1-dimethylpropyl)dioxy]-
CAS Number:
17742-79-9
Molecular Formula:
C6H14O3
Molecular Weight:
134.1736
IUPAC Name:
2-methylbutan-2-ylperoxymethanol
InChI:
InChI=1S/C6H14O3/c1-4-6(2,3)9-8-5-7/h7H,4-5H2,1-3H3
InChI Key:
ATZOJTMZIMSDJV-UHFFFAOYSA-N
SMILES:
OCOOC(CC)(C)C
Properties
Complexity:
70.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.094g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
134.175g/mol
Monoisotopic Mass:
134.094g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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