Home Nitriles 1-Isopropyl-1H-pyrrole-2-carbonitrile

1-Isopropyl-1H-pyrrole-2-carbonitrile

CAS No.:
101001-62-1
Catalog Number:
AG009Q3Y
Molecular Formula:
C8H10N2
Molecular Weight:
134.1784
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:
AG009Q3Y
Chemical Name:
1-Isopropyl-1H-pyrrole-2-carbonitrile
CAS Number:
101001-62-1
Molecular Formula:
C8H10N2
Molecular Weight:
134.1784
MDL Number:
MFCD18447683
IUPAC Name:
1-propan-2-ylpyrrole-2-carbonitrile
InChI:
InChI=1S/C8H10N2/c1-7(2)10-5-3-4-8(10)6-9/h3-5,7H,1-2H3
InChI Key:
KNUDXOAAJPLEGC-UHFFFAOYSA-N
SMILES:
N#Cc1cccn1C(C)C
Properties
Complexity:
154  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
134.084g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
134.182g/mol
Monoisotopic Mass:
134.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties