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16825-51-7 | 1,3-Dioxolane, 2-(4-methoxyphenyl)-4,4,5,5-tetramethyl-
CAS No: 16825-51-7 Catalog No: AG001XXU MDL No:
Product Description
Catalog Number:
AG001XXU
Chemical Name:
1,3-Dioxolane, 2-(4-methoxyphenyl)-4,4,5,5-tetramethyl-
CAS Number:
16825-51-7
Molecular Formula:
C14H20O3
Molecular Weight:
236.3068
IUPAC Name:
2-(4-methoxyphenyl)-4,4,5,5-tetramethyl-1,3-dioxolane
InChI:
InChI=1S/C14H20O3/c1-13(2)14(3,4)17-12(16-13)10-6-8-11(15-5)9-7-10/h6-9,12H,1-5H3
InChI Key:
IIJUTXGJCNYTNW-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1OC(C(O1)(C)C)(C)C
Properties
Complexity:
249
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.141g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.311g/mol
Monoisotopic Mass:
236.141g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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