Home Nitriles 3-Oxo-3-(1h-pyrrol-2-yl)propanenitrile

3-Oxo-3-(1h-pyrrol-2-yl)propanenitrile

CAS No.:
90908-89-7
Catalog Number:
AG00GVGD
Molecular Formula:
C7H6N2O
Molecular Weight:
134.1353
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$58
- +
250mg
95%
In Stock USA
United States
$111
- +
1g
95%
In Stock USA
United States
$221
- +
5g
95%
In Stock USA
United States
$662
- +
Product Description
Catalog Number:
AG00GVGD
Chemical Name:
3-Oxo-3-(1h-pyrrol-2-yl)propanenitrile
CAS Number:
90908-89-7
Molecular Formula:
C7H6N2O
Molecular Weight:
134.1353
MDL Number:
MFCD07369265
IUPAC Name:
3-oxo-3-(1H-pyrrol-2-yl)propanenitrile
InChI:
InChI=1S/C7H6N2O/c8-4-3-7(10)6-2-1-5-9-6/h1-2,5,9H,3H2
InChI Key:
LMNWETGSSJEVSH-UHFFFAOYSA-N
SMILES:
N#CCC(=O)c1ccc[nH]1
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.048g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
134.138g/mol
Monoisotopic Mass:
134.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
56.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties