Home Nitriles 1-Pyrrolidinecarbonitrile,2,5-dioxo-(9CI)

1-Pyrrolidinecarbonitrile,2,5-dioxo-(9CI)

CAS No.:
135205-66-2
Catalog Number:
AG00A8LI
Molecular Formula:
C5H4N2O2
Molecular Weight:
124.0975
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00A8LI
Chemical Name:
1-Pyrrolidinecarbonitrile,2,5-dioxo-(9CI)
CAS Number:
135205-66-2
Molecular Formula:
C5H4N2O2
Molecular Weight:
124.0975
MDL Number:
MFCD12923579
IUPAC Name:
2,5-dioxopyrrolidine-1-carbonitrile
InChI:
InChI=1S/C5H4N2O2/c6-3-7-4(8)1-2-5(7)9/h1-2H2
InChI Key:
CSROIMRWFUGMQC-UHFFFAOYSA-N
SMILES:
N#CN1C(=O)CCC1=O
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.027g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.099g/mol
Monoisotopic Mass:
124.027g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
61.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Properties