Butanoic acid, 4,4,4-trifluoro-


Chemical Name: Butanoic acid, 4,4,4-trifluoro-
CAS Number: 406-93-9
Product Number: AG003KCU(AGN-PC-0KKXZK)
Synonyms:
MDL No:
Molecular Formula: C4H5F3O2
Molecular Weight: 142.0765

Identification/Properties


Properties
MP:
30°C
BP:
149.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
n20/D 1.351
Computed Properties
Molecular Weight:
142.077g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
142.024g/mol
Monoisotopic Mass:
142.024g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
107
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#:
3261
Hazard Statements:
H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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