4-amino-2-fluoro-5-methoxybenzonitrile


Chemical Name: 4-amino-2-fluoro-5-methoxybenzonitrile
CAS Number: 1441723-24-5
Product Number: AG001J1N(AGN-PC-0JK263)
Synonyms:
MDL No: MFCD26407017
Molecular Formula: C8H7FN2O
Molecular Weight: 166.1524

Identification/Properties


Properties
BP:
312.5°C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
166.155g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
166.054g/mol
Monoisotopic Mass:
166.054g/mol
Topological Polar Surface Area:
59A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
201
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
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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