3-bromo-4-formylbenzonitrile


Chemical Name: 3-bromo-4-formylbenzonitrile
CAS Number: 89891-69-0
Product Number: AG00GTG0(AGN-PC-02UQRL)
Synonyms:
MDL No:
Molecular Formula: C8H4BrNO
Molecular Weight: 210.0275

Identification/Properties


Computed Properties
Molecular Weight:
210.03g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
208.948g/mol
Monoisotopic Mass:
208.948g/mol
Topological Polar Surface Area:
40.9A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
196
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


NMR Spectrum


Other Analytical Data


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