Acetic acid, (2-acetylphenoxy)-, methyl ester


Chemical Name: Acetic acid, (2-acetylphenoxy)-, methyl ester
CAS Number: 77956-92-4
Product Number: AG00ICWP(AGN-PC-00MLI6)
Synonyms:
MDL No: MFCD00119145
Molecular Formula: C11H12O4
Molecular Weight: 208.2106

Identification/Properties


Computed Properties
Molecular Weight:
208.213g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
208.074g/mol
Monoisotopic Mass:
208.074g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
237
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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