Benzonitrile, 5-(bromomethyl)-2-fluoro-


Chemical Name: Benzonitrile, 5-(bromomethyl)-2-fluoro-
CAS Number: 180302-35-6
Product Number: AG0021VT(AGN-PC-0KKVSL)
Synonyms:
MDL No: MFCD03094341
Molecular Formula: C8H5BrFN
Molecular Weight: 214.0344

Identification/Properties


Properties
MP:
49-51°C
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Stability:
Lachrymatory
Computed Properties
Molecular Weight:
214.037g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
212.959g/mol
Monoisotopic Mass:
212.959g/mol
Topological Polar Surface Area:
23.8A^2
Heavy Atom Count:
11
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#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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