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82224-53-1 | PHENYL 2-ACETYLOXYPROPANOATE
CAS No: 82224-53-1 Catalog No: AG0056FE MDL No:
Product Description
Catalog Number:
AG0056FE
Chemical Name:
PHENYL 2-ACETYLOXYPROPANOATE
CAS Number:
82224-53-1
Molecular Formula:
C11H12O4
Molecular Weight:
208.2106
IUPAC Name:
phenyl 2-acetyloxypropanoate
InChI:
InChI=1S/C11H12O4/c1-8(14-9(2)12)11(13)15-10-6-4-3-5-7-10/h3-8H,1-2H3
InChI Key:
DFDWIGBFYINJEX-UHFFFAOYSA-N
SMILES:
CC(C(=O)Oc1ccccc1)OC(=O)C
NSC Number:
406315
Properties
Complexity:
231
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.074g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.213g/mol
Monoisotopic Mass:
208.074g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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