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144152-28-3 | Ethanone, 1-[2,6-bis(acetyloxy)phenyl]-
CAS No: 144152-28-3 Catalog No: AG001J0V MDL No:
Product Description
Catalog Number:
AG001J0V
Chemical Name:
Ethanone, 1-[2,6-bis(acetyloxy)phenyl]-
CAS Number:
144152-28-3
Molecular Formula:
C12H12O5
Molecular Weight:
236.2207
IUPAC Name:
(2-acetyl-3-acetyloxyphenyl) acetate
InChI:
InChI=1S/C12H12O5/c1-7(13)12-10(16-8(2)14)5-4-6-11(12)17-9(3)15/h4-6H,1-3H3
InChI Key:
BQSKGNHSFVZDGZ-UHFFFAOYSA-N
SMILES:
CC(=O)c1c(cccc1OC(=O)C)OC(=O)C
Properties
Complexity:
299
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.068g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.223g/mol
Monoisotopic Mass:
236.068g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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