Benzeneacetic acid, a,a-difluoro-


Chemical Name: Benzeneacetic acid, a,a-difluoro-
CAS Number: 360-03-2
Product Number: AG00I751(AGN-PC-0RBHLT)
Synonyms:
MDL No:
Molecular Formula: C8H6F2O2
Molecular Weight: 172.1288

Identification/Properties


Properties
MP:
76-77°C
BP:
258.1°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
172.131g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
172.034g/mol
Monoisotopic Mass:
172.034g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
174
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:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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