2-Propenal, 3-(5-nitro-2-furanyl)-, (2E)-


Chemical Name: 2-Propenal, 3-(5-nitro-2-furanyl)-, (2E)-
CAS Number: 52661-56-0
Product Number: AG00DJQD(AGN-PC-0OBQZO)
Synonyms:
MDL No:
Molecular Formula: C7H5NO4
Molecular Weight: 167.1189

Identification/Properties


Computed Properties
Molecular Weight:
167.12g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
167.022g/mol
Monoisotopic Mass:
167.022g/mol
Topological Polar Surface Area:
76A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
208
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


Other Analytical Data


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