Propanoic acid, 3,3,3-trifluoro-, ethyl ester


Chemical Name: Propanoic acid, 3,3,3-trifluoro-, ethyl ester
CAS Number: 352-23-8
Product Number: AG00C7FW(AGN-PC-0KL1LN)
Synonyms:
MDL No:
Molecular Formula: C5H7F3O2
Molecular Weight: 156.1031

Identification/Properties


Computed Properties
Molecular Weight:
156.104g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
156.04g/mol
Monoisotopic Mass:
156.04g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
119
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#:
3272
Hazard Statements:
H319-H225-H335-H315
Precautionary Statements:
P233-P210-P280-P305+P351+P338
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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