Benzenepropanoic acid, 2-fluoro-4-methoxy-, ethyl ester


Chemical Name: Benzenepropanoic acid, 2-fluoro-4-methoxy-, ethyl ester
CAS Number: 691904-77-5
Product Number: AG00IBWU(AGN-PC-03YL7J)
Synonyms:
MDL No: MFCD18396469
Molecular Formula: C12H15FO3
Molecular Weight: 226.2441

Identification/Properties


Computed Properties
Molecular Weight:
226.247g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
226.101g/mol
Monoisotopic Mass:
226.101g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
220
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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