Benzoic acid, 2,6-difluoro-


Chemical Name: Benzoic acid, 2,6-difluoro-
CAS Number: 385-00-2
Product Number: AG00331K(AGN-PC-0JK99B)
Synonyms:
MDL No:
Molecular Formula: C7H4F2O2
Molecular Weight: 158.1023

Identification/Properties


Properties
MP:
157-161 °C(lit.)
BP:
231°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
158.104g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
158.018g/mol
Monoisotopic Mass:
158.018g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
151
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-H412
Precautionary Statements:
P261-P273-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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