3-(5-bromofuran-2-yl)-3-oxopropanenitrile


Chemical Name: 3-(5-bromofuran-2-yl)-3-oxopropanenitrile
CAS Number: 93277-17-9
Product Number: AG00GT56(AGN-PC-00M1G5)
Synonyms:
MDL No: MFCD07785839
Molecular Formula: C7H4BrNO2
Molecular Weight: 214.0162

Identification/Properties


Computed Properties
Molecular Weight:
214.018g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
212.943g/mol
Monoisotopic Mass:
212.943g/mol
Topological Polar Surface Area:
54A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
208
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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