Home Nitriles 5-Ethyl-1h-pyrrole-2-carbonitrile

5-Ethyl-1h-pyrrole-2-carbonitrile

CAS No.:
159326-76-8
Catalog Number:
AG00J2MA
Molecular Formula:
C7H8N2
Molecular Weight:
120.1518
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
- +
5g
95%
In Stock USA
United States
$216
- +
Product Description
Catalog Number:
AG00J2MA
Chemical Name:
5-Ethyl-1h-pyrrole-2-carbonitrile
CAS Number:
159326-76-8
Molecular Formula:
C7H8N2
Molecular Weight:
120.1518
MDL Number:
MFCD19982762
IUPAC Name:
5-ethyl-1H-pyrrole-2-carbonitrile
InChI:
InChI=1S/C7H8N2/c1-2-6-3-4-7(5-8)9-6/h3-4,9H,2H2,1H3
InChI Key:
JJHPJKNNGFQBAL-UHFFFAOYSA-N
SMILES:
CCc1ccc([nH]1)C#N
Properties
Complexity:
133  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
120.069g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
120.155g/mol
Monoisotopic Mass:
120.069g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
39.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties