Home Nitriles 2-(1-methyl-5-oxopyrrolidin-3-yl)acetonitrile

2-(1-methyl-5-oxopyrrolidin-3-yl)acetonitrile

CAS No.:
1782840-52-1
Catalog Number:
AG01AD2J
Molecular Formula:
C7H10N2O
Molecular Weight:
138.1671
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Product Description
Catalog Number:
AG01AD2J
Chemical Name:
2-(1-methyl-5-oxopyrrolidin-3-yl)acetonitrile
CAS Number:
1782840-52-1
Molecular Formula:
C7H10N2O
Molecular Weight:
138.1671
MDL Number:
MFCD28550092
IUPAC Name:
2-(1-methyl-5-oxopyrrolidin-3-yl)acetonitrile
InChI:
InChI=1S/C7H10N2O/c1-9-5-6(2-3-8)4-7(9)10/h6H,2,4-5H2,1H3
InChI Key:
KGLKAKINVYANGE-UHFFFAOYSA-N
SMILES:
N#CCC1CC(=O)N(C1)C
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.079g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
138.17g/mol
Monoisotopic Mass:
138.079g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties