2-Furancarbonitrile, 5-acetyl- (9CI)


Chemical Name: 2-Furancarbonitrile, 5-acetyl- (9CI)
CAS Number: 133674-71-2
Product Number: AG0080BK(AGN-PC-03E0E2)
Synonyms:
MDL No:
Molecular Formula: C7H5NO2
Molecular Weight: 135.1201

Identification/Properties


Computed Properties
Molecular Weight:
135.122g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
135.032g/mol
Monoisotopic Mass:
135.032g/mol
Topological Polar Surface Area:
54A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
191
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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