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145354-82-1 | 1,3-Dioxolane-2-methanol, 4-(acetyloxy)-, 2-benzoate
CAS No: 145354-82-1 Catalog No: AG001KUK MDL No:
Product Description
Catalog Number:
AG001KUK
Chemical Name:
1,3-Dioxolane-2-methanol, 4-(acetyloxy)-, 2-benzoate
CAS Number:
145354-82-1
Molecular Formula:
C13H14O6
Molecular Weight:
266.2467
IUPAC Name:
(4-acetyloxy-1,3-dioxolan-2-yl)methyl benzoate
InChI:
InChI=1S/C13H14O6/c1-9(14)18-12-8-16-11(19-12)7-17-13(15)10-5-3-2-4-6-10/h2-6,11-12H,7-8H2,1H3
InChI Key:
HZFOOXNVWXVDJP-UHFFFAOYSA-N
SMILES:
CC(=O)OC1COC(O1)COC(=O)c1ccccc1
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.079g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.249g/mol
Monoisotopic Mass:
266.079g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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