1H-Pyrrole-2-propanenitrile, b-oxo-


Chemical Name: 1H-Pyrrole-2-propanenitrile, b-oxo-
CAS Number: 90908-89-7
Product Number: AG00GVGD(AGN-PC-0VRD0D)
Synonyms:
MDL No:
Molecular Formula: C7H6N2O
Molecular Weight: 134.1353

Identification/Properties


Properties
MP:
75-77°C
Form:
Solid
Computed Properties
Molecular Weight:
134.138g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
134.048g/mol
Monoisotopic Mass:
134.048g/mol
Topological Polar Surface Area:
56.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
179
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


Request for Quotation


Customer Feedback