Home Nitriles 1-Methyl-1h-pyrrole-3-carbonitrile

1-Methyl-1h-pyrrole-3-carbonitrile

CAS No.:
7126-46-7
Catalog Number:
AG00FSDP
Molecular Formula:
C6H6N2
Molecular Weight:
106.1252
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$129
- +
5g
95%
In Stock USA
United States
$316
- +
Product Description
Catalog Number:
AG00FSDP
Chemical Name:
1-Methyl-1h-pyrrole-3-carbonitrile
CAS Number:
7126-46-7
Molecular Formula:
C6H6N2
Molecular Weight:
106.1252
MDL Number:
MFCD11111734
IUPAC Name:
1-methylpyrrole-3-carbonitrile
InChI:
InChI=1S/C6H6N2/c1-8-3-2-6(4-7)5-8/h2-3,5H,1H3
InChI Key:
VZSLEHOZJCZYJD-UHFFFAOYSA-N
SMILES:
N#Cc1ccn(c1)C
Properties
Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
106.053g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
106.128g/mol
Monoisotopic Mass:
106.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties