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132294-16-7 | Cyclobutanone, 2,3-bis[(benzoyloxy)methyl]-, (2S,3S)-
CAS No: 132294-16-7 Catalog No: AG0010HT MDL No:
Product Description
Catalog Number:
AG0010HT
Chemical Name:
Cyclobutanone, 2,3-bis[(benzoyloxy)methyl]-, (2S,3S)-
CAS Number:
132294-16-7
Molecular Formula:
C20H18O5
Molecular Weight:
338.3539
IUPAC Name:
[2-(benzoyloxymethyl)-3-oxocyclobutyl]methyl benzoate
InChI:
InChI=1S/C20H18O5/c21-18-11-16(12-24-19(22)14-7-3-1-4-8-14)17(18)13-25-20(23)15-9-5-2-6-10-15/h1-10,16-17H,11-13H2
InChI Key:
RYWNYUWMBMTYBG-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1)OC[C@H]1CC(=O)[C@@H]1COC(=O)c1ccccc1
Properties
Complexity:
488
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.115g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
338.359g/mol
Monoisotopic Mass:
338.115g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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