Propanoic acid, 2-fluoro-2-methyl-, methyl ester


Chemical Name: Propanoic acid, 2-fluoro-2-methyl-, methyl ester
CAS Number: 338-76-1
Product Number: AG003RNT(AGN-PC-0MTMA2)
Synonyms:
MDL No:
Molecular Formula: C5H9FO2
Molecular Weight: 120.1222

Identification/Properties


Properties
BP:
112.3°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Refractive Index:
1.3740 to 1.3780
Computed Properties
Molecular Weight:
120.123g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
120.059g/mol
Monoisotopic Mass:
120.059g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
98.6
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:
Signal Word:
Danger
UN#:
2924
Hazard Statements:
H225-H314
Precautionary Statements:
P210-P280-P370+P378-P303+P361+P353-P304+P340+P310-P305+P351+P338+P310
Class:
3,8
Packing Group:

NMR Spectrum


Other Analytical Data


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